Arachidonic Acid
PubChem CID: 444899
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| Compound Synonyms | arachidonic acid, 506-32-1, arachidonate, (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid, Immunocytophyte, (all-Z)-5,8,11,14-Eicosatetraenoic acid, cis-5,8,11,14-Eicosatetraenoic acid, 5,8,11,14-Eicosatetraenoic acid, (all-Z)-, all-cis-5,8,11,14-eicosatetraenoic acid, Arachidonsaeure, 5Z,8Z,11Z,14Z-eicosatetraenoic acid, (5Z,8Z,11Z,14Z)-5,8,11,14-Eicosatetraenoic Acid, UNII-27YG812J1I, CCRIS 6312, CHEBI:15843, 27YG812J1I, EINECS 208-033-4, MFCD00004417, CHEMBL15594, AI3-09613, DTXSID4040420, Icosa-5,8,11,14-tetraenoic acid, (5Z,8Z,11Z,14Z)-5,8,11,14-Eikosatetraensaeure, 5Z,8Z,11Z,14Z-icosatetraenoic acid, FA 20:4, ARACHIDONIC ACID (20:4, n-6), (5Z,8Z,11Z,14Z)-Icosatetraenoic acid, C20:4, cis-Delta(5,8,11,14)-eicosatetraenoic acid, [1-14C]Arachidonic acid, 93444-49-6, (5Z,8Z,11Z,14Z)-5,8,11,14-Icosatetraenoic acid, ARACHIDONIC ACID (MART.), ARACHIDONIC ACID [MART.], 5Z,8Z,11Z,14Z-Eicosatetraenoate, (14C)Arachidonic acid, Arachidonic Acid, 99%, Arachidonic Acid, >97%, Arachidonic Acid-d8 (Major, 10mg/ml in Methyl Acetate), arachidonic-acid, cis-5,8,11,14-Eicosatetraenoic acid Solution in Methanol, 1000ug/mL, 1adl, 1gnj, 1vyg, (5Z,8Z,11Z,14Z)-5,8,11,14-Eicosatetraenoic-5,6,8,9,11,12,14,15-d8 Acid, (all-Z)-5,8,11,14-Eicosatetraenoic-5,6,8,9,11,12,14,15-d8 Acid, Arachidonic Acid-5,6,8,9,11,12,14,15-2H8, , cis,cis,cis,cis-5,8,11,14-Eicosatetraenoic acid, (14C)-arachidonic acid, Spectrum5_001910, Arachidonic acid - 10%, Arachidonic acid - 40%, Arachidonic acid - 98%, Fatty Acid 20:4 n-6, SCHEMBL16162, BSPBio_001539, MLS001361328, ARACHIDONIC ACID [MI], AA-[d8], BML3-B03, GTPL2391, 5,8,11,14-Eicosatetraenoate, DTXCID2020420, BDBM22319, ARACHIDONIC ACID [WHO-DD], CHEBI:137828, HMS1361M21, HMS1791M21, HMS1989M21, HMS3402M21, HMS3649B05, Arachidonic acid, >95.0% (GC), 5,8,11,14-Eicosatetraenoic acid, labeled with carbon-14, (all-Z)-, Arachidonic acid, analytical standard, cis-D5,8,11,14-Eicosatetraenoate, LMFA01030001, s6185, AKOS015950830, MSK1762-1000M, CCG-214838, DB04557, FA40762, FA76490, FS-5880, 5,8,11,14-all-cis-Eicosatetraenoate, all-cis-5,8,11,14-Eicosatetraenoate, ARACHIDONIC ACID (20:4 n-6), IDI1_034009, cis-D5,8,11,14-Eicosatetraenoic acid, NCGC00094608-01, NCGC00094608-02, NCGC00094608-03, NCGC00094608-04, NCGC00094608-05, NCGC00094608-06, (all-Z)-5,8,11,14-Eicosatetraenoate, AC-14348, AC-33769, BP-29803, Eicosa-5Z,8Z,11Z,14Z-tetraenoic acid, FA165223, SMR000857374, 1ST1762-1000M, 5,8,11,14-all-cis-Eicosatetraenoic acid, All-cis-icosa-5,8,11,14-tetraenoic acid, HY-109590, A0781, all-cis-eicosa-5,8,11,14-tetraenoic acid, CS-0032762, 5-cis,8-cis,11-cis,14-cis-Eicosatetraenoate, C00219, W15452, FA(20:4(5Z,8Z,11Z,14Z)), 5-cis,8-cis,11-cis,14-cis-Eicosatetraenoic acid, Q407699, SR-01000838311, SR-01000838311-2, BRD-K03070961-001-02-8, BRD-K03070961-001-04-4, BRD-K03070961-001-08-5, BRD-K03070961-001-10-1, (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoicacid, (5Z,8Z,11Z,14Z)-5,8,11,14-Icosatetraenoic acid #, Arachidonic acid, from non-animal source, >=98.5% (GC), Arachidonic acid, from porcine liver, >=99% (GC), liquid, D18DBC10-379C-4E78-9A50-8B791A2F4E68, Arachidonic acid, from porcine liver, >=85% (capillary GC), liquid, Arachidonic acid, 1.0 mg/mL in ethanol, certified reference material, Arachidonic acid, from porcine liver, BioReagent, suitable for cell culture, >=99% (GC) |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 37.3 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Np Classifier Class | Unsaturated fatty acids |
| Deep Smiles | CCCCC/C=CC/C=CC/C=CC/C=CCCCC=O)O |
| Heavy Atom Count | 22.0 |
| Classyfire Class | Fatty acyls |
| Description | Essential fatty acid. Constituent of many animal phospholipids Arachidonic acid (AA, sometimes ARA) is a polyunsaturated omega-6 fatty acid 20:4(omega-6). It is the counterpart to the saturated arachidic acid found in peanut oil, (L. arachis – peanut.) . |
| Classyfire Subclass | Fatty acids and conjugates |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 362.0 |
| Database Name | cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P49327, P39877, Q9BZM2, P47712, P04054, Q9BX93, O15496, Q9UHV8, Q9NZK7, Q9BZM1, O60733, Q05315, P14555, Q9UNK4, P16233, P11150, P54315, Q9NST1, P07098, Q9Y5X9, P19835, P54317, P06858, Q02928, P23141, O00748, P06276, Q9UP65, Q05469, Q9NZ20, Q14032, P14621, P07311, Q03154, P45381, Q96HD9, P09917, O15296, P18054, P35354, P23219, P16050, P78329, Q08477, P08684, P11712, P33261, O00154, P49753, Q8N9L9, O14734, Q13510, Q86Z02, P05181, Q9HBI6, Q9HB55, Q16678, P33260, P24903, Q8N118, P20813, P20815, Q16696, P24462, P13584, Q86W10, P05177, P11511, P10632, Q96SQ9, P98187, P51589, P20853, P11509, P37231, Q9Y2P4, O00519, O75342, Q5K4L6, P41247, Q6PCB7, Q92959, Q6P1M0, Q5TCH4, Q86U10, Q6P1J6, Q96AD5, A0N0X8, Q86XP0, Q3MJ16, Q68DD2, Q9NP80, Q6NT55, P0C869, P0C7U2, Q5QJU3, Q9NR71, Q6GMR7, Q6NWU0, Q6NT32, Q8TDN7, Q8IY17, Q8TDS5, Q17RR3, Q86TX2, Q53FV7, Q6UWW8, Q86WD1, Q6FHZ7, Q9UEF6, Q53EW1, A2RRE8, Q6L9M1, A5PLL0, P53816, P15090, Q16850, P13726, P00761, O62664, P79208, Q03164, P02545, P46063, Q99714, B2RXH2, Q9NUW8, P10636, P25779, P51450, P00352, Q962Y6, Q9F4F7, Q9Y468, O75604, P15428, P04637, P29466, P54132, Q92830, Q96KQ7, P11473, Q9HC16, Q9UBT6, O94782, P11021, Q00910, Q07869, Q03181, Q9NPD5, Q9Y6L6, P27695, P22002, Q9WUD2, Q16762, Q7BGE6, P61604, P0A6F5 |
| Iupac Name | (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid |
| Prediction Hob | 0.0 |
| Class | Fatty Acyls |
| Veber Rule | False |
| Classyfire Superclass | Lipids and lipid-like molecules |
| Target Id | NPT441, NPT483, NPT47, NPT149, NPT48, NPT50, NPT51, NPT94, NPT792, NPT864, NPT45, NPT151, NPT539, NPT277, NPT58, NPT109, NPT866, NPT106, NPT99, NPT72, NPT73 |
| Xlogp | 6.3 |
| Superclass | Lipids and lipid-like molecules |
| Subclass | Fatty acids and conjugates |
| Gsk 4 400 Rule | False |
| Molecular Formula | C20H32O2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | YZXBAPSDXZZRGB-DOFZRALJSA-N |
| Silicos It Class | Moderately soluble |
| Fcsp3 | 0.55 |
| Logs | -2.891 |
| Rotatable Bond Count | 14.0 |
| State | Liquid |
| Logd | 3.025 |
| Synonyms | (5Z,8Z,11Z,14Z)-5,8,11,14-Icosatetraenoate, (5Z,8Z,11Z,14Z)-5,8,11,14-Icosatetraenoic acid, (5Z,8Z,11Z,14Z)-Icosatetraenoate, (5Z,8Z,11Z,14Z)-Icosatetraenoic acid, (all-Z)-5,8,11,14-Eicosatetraenoate, (all-Z)-5,8,11,14-Eicosatetraenoic acid, 5-cis,8-cis,11-cis,14-cis-Eicosatetraenoate, 5-cis,8-cis,11-cis,14-cis-Eicosatetraenoic acid, 5,8,11,14-all-cis-Eicosatetraenoate, 5,8,11,14-all-cis-Eicosatetraenoic acid, 5,8,11,14-Eicosatetraenoic acid, (all-Z)-, 5Z,8Z,11Z,14Z-Eicosatetraenoate, 5Z,8Z,11Z,14Z-Eicosatetraenoic acid, AA, all-cis-5,8,11,14-Eicosatetraenoate, all-cis-5,8,11,14-Eicosatetraenoic acid, ARA, Arachidonate, Arachidonic acid, Arachidonsaeure, cis-5,8,11,14-Eicosatetraenoate, cis-5,8,11,14-eicosatetraenoic acid, cis-delta-5,8,11,14-eicosatetraenoic acid, cis-delta(5,8,11,14)-Eicosatetraenoate, cis-Delta(5,8,11,14)-Eicosatetraenoic acid, cis-δ(5,8,11,14)-eicosatetraenoate, cis-δ(5,8,11,14)-eicosatetraenoic acid, cis-5,8,11,14-Eicosatetraenoic acid, (5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid, cis-Δ(5,8,11,14)-eicosatetraenoate, cis-Δ(5,8,11,14)-eicosatetraenoic acid, (5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoate, 5,8,11,14-Eicosatetraenoate, 5,8,11,14-Eicosatetraenoic acid, cis-D5,8,11,14-Eicosatetraenoate, cis-D5,8,11,14-Eicosatetraenoic acid, Immunocytophyte, Arachidonate, sodium, Arachidonic acid, (all-Z)-isomer, 3H-labeled, Arachidonic acid, ammonium salt, (all-Z)-isomer, Arachidonic acid, cerium salt, (all-Z)-isomer, Arachidonic acid, sodium salt, Arachidonic acid, sodium salt, (all-Z)-isomer, Vitamin F, Arachidonic acid, cesium salt, (all-Z)-isomer, Arachidonic acid, lithium salt, (all-Z)-isomer, Arachidonic acid, potassium salt, (all-Z)-isomer, Sodium arachidonate, Arachidonic acid, (all-Z)-isomer, 1-(14)C-labeled, Arachidonic acid, zinc salt, (all-Z)-isomer, FA(20:4(5Z,8Z,11Z,14Z)), FA(20:4n6), arachidonates, arachidonic acid, arachidonic-acid |
| Substituent Name | Long-chain fatty acid, Unsaturated fatty acid, Straight chain fatty acid, Monocarboxylic acid or derivatives, Carboxylic acid, Carboxylic acid derivative, Hydrocarbon derivative, Organooxygen compound, Carbonyl group, Aliphatic acyclic compound |
| Esol Class | Soluble |
| Functional Groups | C/C=CC, CC(=O)O |
| Compound Name | Arachidonic Acid |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 304.24 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 304.24 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 304.5 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 4.0 |
| Molecular Framework | Aliphatic acyclic compounds |
| Lipinski Rule Of 5 | True |
| Esol | -5.2011388 |
| Inchi | InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15- |
| Smiles | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O |
| Nring | 0.0 |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 4.0 |
| Egan Rule | False |
| Taxonomy Direct Parent | Long-chain fatty acids |
| Np Classifier Superclass | Fatty Acids and Conjugates |
- 1. Outgoing r'ship
FOUND_INto/from Acanthosyris Spinescens (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Agrimonia Eupatoria (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Allium Sativum (Plant) Rel Props:Source_db:fooddb_chem_all - 4. Outgoing r'ship
FOUND_INto/from Alluaudia Humbertii (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 5. Outgoing r'ship
FOUND_INto/from Alstonia Lanceolifera (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 6. Outgoing r'ship
FOUND_INto/from Artemisia Caerulescens (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 7. Outgoing r'ship
FOUND_INto/from Asclepias Curassavica (Plant) Rel Props:Reference:ISBN:9788172361150; ISBN:9788185042053 - 8. Outgoing r'ship
FOUND_INto/from Basella Alba (Plant) Rel Props:Reference:ISBN:9788185042145 - 9. Outgoing r'ship
FOUND_INto/from Blighia Sapida (Plant) Rel Props:Reference:ISBN:9788185042053 - 10. Outgoing r'ship
FOUND_INto/from Brassica Oleracea (Plant) Rel Props:Source_db:cmaup_ingredients;fooddb_chem_all;npass_chem_all - 11. Outgoing r'ship
FOUND_INto/from Campanula Medium (Plant) Rel Props:Source_db:npass_chem_all - 12. Outgoing r'ship
FOUND_INto/from Cheilanthes Tenuifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 13. Outgoing r'ship
FOUND_INto/from Curcuma Aromatica (Plant) Rel Props:Reference:ISBN:9770972795006 - 14. Outgoing r'ship
FOUND_INto/from Curcuma Longa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 15. Outgoing r'ship
FOUND_INto/from Daucus Carota (Plant) Rel Props:Source_db:fooddb_chem_all - 16. Outgoing r'ship
FOUND_INto/from Dysphania Ambrosioides (Plant) Rel Props:Reference:ISBN:9788172362089 - 17. Outgoing r'ship
FOUND_INto/from Echinops Spinosissimus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 18. Outgoing r'ship
FOUND_INto/from Epilobium Parviflorum (Plant) Rel Props:Reference:ISBN:9788172362300 - 19. Outgoing r'ship
FOUND_INto/from Eruca Vesicaria (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 20. Outgoing r'ship
FOUND_INto/from Euphorbia Nivulia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 21. Outgoing r'ship
FOUND_INto/from Fagopyrum Esculentum (Plant) Rel Props:Source_db:cmaup_ingredients;fooddb_chem_all;npass_chem_all - 22. Outgoing r'ship
FOUND_INto/from Gleditsia Triacanthos (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 23. Outgoing r'ship
FOUND_INto/from Glycine Max (Plant) Rel Props:Source_db:fooddb_chem_all - 24. Outgoing r'ship
FOUND_INto/from Hedyotis Lawsoniae (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 25. Outgoing r'ship
FOUND_INto/from Helipterum Venustum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 26. Outgoing r'ship
FOUND_INto/from Humboldtia Laurifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 27. Outgoing r'ship
FOUND_INto/from Ilex Macropoda (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 28. Outgoing r'ship
FOUND_INto/from Jasminum Mesnyi (Plant) Rel Props:Reference:ISBN:9788185042114 - 29. Outgoing r'ship
FOUND_INto/from Luffa Cylindrica (Plant) Rel Props:Reference:ISBN:9788172361792 - 30. Outgoing r'ship
FOUND_INto/from Lycium Cestroides (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 31. Outgoing r'ship
FOUND_INto/from Magnolia Salicifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 32. Outgoing r'ship
FOUND_INto/from Matteuccia Struthiopteris (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 33. Outgoing r'ship
FOUND_INto/from Monostroma Fuscum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 34. Outgoing r'ship
FOUND_INto/from Moringa Oleifera (Plant) Rel Props:Reference:ISBN:9770972795006 - 35. Outgoing r'ship
FOUND_INto/from Morus Alba (Plant) Rel Props:Reference:https://doi.org/10.15482/usda.adc/1239279 - 36. Outgoing r'ship
FOUND_INto/from Mukia Maderaspatana (Plant) Rel Props:Reference:ISBN:9770972795006 - 37. Outgoing r'ship
FOUND_INto/from Myristica Fragrans (Plant) Rel Props:Reference:ISBN:9770972795006 - 38. Outgoing r'ship
FOUND_INto/from Myroxylon Balsamum (Plant) Rel Props:Source_db:npass_chem_all - 39. Outgoing r'ship
FOUND_INto/from Nigella Sativa (Plant) Rel Props:Reference:https://doi.org/10.15482/usda.adc/1239279 - 40. Outgoing r'ship
FOUND_INto/from Paepalanthus Hilairei (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 41. Outgoing r'ship
FOUND_INto/from Palhinhaea Cernua (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 42. Outgoing r'ship
FOUND_INto/from Persea Americana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 43. Outgoing r'ship
FOUND_INto/from Pieris Formosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 44. Outgoing r'ship
FOUND_INto/from Portulaca Oleracea (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 45. Outgoing r'ship
FOUND_INto/from Prunus Persica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 46. Outgoing r'ship
FOUND_INto/from Pterocaulon Alopecuroides (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 47. Outgoing r'ship
FOUND_INto/from Rhabdodendron Amazonicum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 48. Outgoing r'ship
FOUND_INto/from Salvia Nemorosa (Plant) Rel Props:Reference:https://doi.org/10.1002/ffj.3389 - 49. Outgoing r'ship
FOUND_INto/from Salvia Officinalis (Plant) Rel Props:Reference:https://doi.org/10.1002/ffj.3389 - 50. Outgoing r'ship
FOUND_INto/from Salvia Pratensis (Plant) Rel Props:Reference:https://doi.org/10.1002/ffj.3389 - 51. Outgoing r'ship
FOUND_INto/from Salvia Sclarea (Plant) Rel Props:Reference:https://doi.org/10.1002/ffj.3389 - 52. Outgoing r'ship
FOUND_INto/from Sclerocarya Birrea (Plant) Rel Props:Reference:ISBN:9788172363093 - 53. Outgoing r'ship
FOUND_INto/from Selaginella Uncinata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 54. Outgoing r'ship
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FOUND_INto/from Sloanea Zuliaensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 57. Outgoing r'ship
FOUND_INto/from Tetracera Rosiflora (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 58. Outgoing r'ship
FOUND_INto/from Teucrium Montanum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 59. Outgoing r'ship
FOUND_INto/from Thespesia Populnea (Plant) Rel Props:Reference:ISBN:9788185042114 - 60. Outgoing r'ship
FOUND_INto/from Tillandsia Fragrans (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 61. Outgoing r'ship
FOUND_INto/from Udotea Cyathiformis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 62. Outgoing r'ship
FOUND_INto/from Uvariopsis Tripetala (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 63. Outgoing r'ship
FOUND_INto/from Valeriana Jatamansi (Plant) Rel Props:Reference:https://doi.org/10.15482/usda.adc/1239279 - 64. Outgoing r'ship
FOUND_INto/from Zingiber Aromaticum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all