Spermine
PubChem CID: 1103
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | spermine, 71-44-3, musculamine, neuridine, gerontine, Spermin, 4,9-Diaza-1,12-dodecanediamine, N,N'-Bis(3-aminopropyl)-1,4-butanediamine, Spermine, puriss, Diaminopropyltetramethylenediamine, N,N'-Bis(3-aminopropyl)butane-1,4-diamine, 1,4-Butanediamine, N,N'-bis(3-aminopropyl)-, 4,9-Diazadodecamethylenediamine, Gerotine, 1,4-Bis(aminopropyl)butanediamine, Spermina, 4,9-Diazadodecane-1,12-diamine, Actilip sp-91, 1,4-Bis(aminopropyl) butanediamine, N1,N1'-(Butane-1,4-diyl)bis(propane-1,3-diamine), NSC 268508, 1,4-Diaminobutane, N,N'-bis(3-aminopropyl)-, BRN 1750791, 1,5,10,14-Tetraazatetradecane, UNII-2FZ7Y3VOQX, 2FZ7Y3VOQX, AI3-26633, EINECS 200-754-2, Spermine free base, MFCD00008215, NSC-268508, CHEBI:15746, NSC 268508, Neuridine, CHEMBL23194, DTXSID9058781, N,N'-Bis(3-aminopropyl)-1,4-diaminobutane, N1,N4-bis(3-aminopropyl)-1,4-butanediamine, diaminopropyl-tetramethylenediamine, 4-04-00-01301 (Beilstein Handbook Reference), NSC268508, 71-44-3 (FREE BASE), (3-aminopropyl)({4-[(3-aminopropyl)amino]butyl})amine, spermidine 3HCl, 1,4-Butanediamine, N1,N4-bis(3-aminopropyl)-, 71052-31-8, SPM, MLS002472980, C10H26N4, Spermina [Italian], SMR001397086, Spermine puriss, EINECS 273-309-3, Spermine (Standard), 4,12-diamine, Spermine, >=97%, Tocris-0958, SPERMINE [MI], Lopac-S-2876, Biomol-NT_000213, bmse000117, EC 273-309-3, NCIMech_000206, Spermine, min. 98.0%, Lopac0_001077, SCHEMBL14965, WLN: Z3M4M3Z, GTPL710, Spermine, analytical standard, BPBio1_001086, DTXCID8046872, BDBM79403, cid_5351186, HY-B1777R, 1, N,N'-bis(3-aminopropyl)-, Spermine, >=99.0% (GC), HY-B1777, CCG-35276, HB0588, HSCI1_000212, s3948, AKOS024258603, DB00127, FS09798, SB38410, SDCCGSBI-0051047.P003, N1,N4-bis(3-aminopropyl)-butanediamine, NCGC00015941-01, NCGC00015941-02, NCGC00015941-03, NCGC00015941-04, NCGC00015941-05, NCGC00015941-10, NCGC00024902-01, NCGC00024902-02, NCGC00024902-03, AS-35114, BP-21388, NCI60_035280, DB-055526, CS-0013806, N,Na?Bis(3-aminopropyl)-1,4-diaminobutane, NS00014922, Spermine, Vetec(TM) reagent grade, >=97%, N,N''-bis(3-aminopropyl)butane-1,4-diamine, N1,N4-Bis(3-aminopropyl)butane-1,4-diamine, C00750, EN300-175597, L001114, n1,n1'-(butane-1,4-diyl)dipropane-1,3-diamine, Q424597, N,N'-Bis(3-aminopropyl)-1,4-tetramethylenediamine, BRD-K18375018-376-02-3, Z1269219211, 2B445AED-6284-43E4-82FE-39598858D67F, 3-aminopropyl-[4-(3-aminopropylamino)butyl]amine, hydrochloride, N,N''''-bis(3-aminopropyl)butane-1,4-diamine, hydrochloride, N,N''''-bis(3-azanylpropyl)butane-1,4-diamine, hydrochloride, N,N'-Bis(3-aminopropyl)-1,4-diaminobutane, Gerontine, Musculamine, Spermine, BioReagent, amorphous semi-solid, suitable for cell culture, 200-754-2 |
|---|---|
| Ghose Rule | True |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 76.1 |
| Hydrogen Bond Donor Count | 4.0 |
| Pfizer 3 75 Rule | True |
| Np Classifier Class | Polyamines |
| Deep Smiles | NCCCNCCCCNCCCN |
| Heavy Atom Count | 14.0 |
| Classyfire Class | Organonitrogen compounds |
| Description | Occurs as phosphate in ox pancreas, yeast and meat products Spermine is a polyamine involved in cellular metabolism found in all eukaryotic cells. Formed from spermidine, it is found in a wide variety of organisms and tissues and is an essential growth factor in some bacteria. It is found as a polycation at physiological pH. Spermine is associated with nucleic acids and is thought to stabilize helical structure, in particular, in viruses. |
| Classyfire Subclass | Amines |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 86.1 |
| Database Name | cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Enzyme Uniprot Id | Q96F10, P21673, P52788, P19623, Q13126, P50440, P19113, P11926, P54368 |
| Uniprot Id | Q96F10, P21673, P47989, Q8NE62, Q9UI17, P52788, P19623, P49189, O75936, P19801, Q13126, P17707, P50440, Q93088, Q9UL12, P19113, P11926, Q9H015, O15245, Q9NWM0, Q9BSE5, Q9NVH6, Q9H2M3, Q8NCN5, P54368, Q6P1K2, Q9TTK6, n.a., Q9R1M7, Q862F3, P14100, P42575, Q12879, P00915, P00918, P07451, P22748, P35218, Q9Y2D0, P23280, P43166, Q16790, O43570, Q9D6N1, Q9ULX7, Q99N23, Q03164, Q99714, P46063, P33261, Q9F4F7, P16050, P08482, P40225, Q96KQ7, O15648, O15296, Q13951, P05177, O89049, P21728, Q9NUW8, P21397, P27338, Q16853, P27695, Q00960, P11388, Q13224, P0DTD1 |
| Iupac Name | N,N'-bis(3-aminopropyl)butane-1,4-diamine |
| Prediction Hob | 1.0 |
| Class | Amines |
| Veber Rule | False |
| Classyfire Superclass | Organic nitrogen compounds |
| Target Id | NPT4104, NPT947, NPT233, NPT1146, NPT1062, NPT1143, NPT1144, NPT1063, NPT955, NPT948, NPT949, NPT954, NPT149, NPT47, NPT213, NPT792, NPT96, NPT208, NPT5859 |
| Xlogp | -1.1 |
| Superclass | Organonitrogen compounds |
| Subclass | Secondary amines |
| Gsk 4 400 Rule | True |
| Molecular Formula | C10H26N4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | PFNFFQXMRSDOHW-UHFFFAOYSA-N |
| Silicos It Class | Soluble |
| Fcsp3 | 1.0 |
| Logs | 0.662 |
| Rotatable Bond Count | 11.0 |
| State | Solid |
| Logd | -2.366 |
| Synonyms | 1,4-Bis(aminopropyl)butanediamine, 1,5,10,14-Tetraazatetradecane, 4,9-Diaza-1,12-dodecanediamine, 4,9-Diazadodecamethylenediamine, 4,9-Diazadodecane-1,12-diamine, Bis(3-aminopropyl)tetramethylenediamine, Diaminopropyl-tetramethylenediamine, Diaminopropyltetramethylenediamine, Gerontine, Musculamine, N,N'-bis(3-aminopropyl)-1,4-butanediamine, N,N'-Bis(3-aminopropyl)-1,4-butanediamine, 9CI, N,N'-Bis(3-aminopropyl)-1,4-diaminobutane, N,N'-Bis(3-aminopropyl)-1,4-tetramethylenediamine, N,N'-Bis(3-aminopropyl)butane-1,4-diamine, N,N'-bis(aminopropyl)-1,4-butanediamine, N1,N4-bis(3-aminopropyl)-1,4-butanediamine, Neuridine, Spermin, Spermine dihydrate, Spermine puriss, SPM, Diferuloylspermine, N,N'-bis(3-aminopropyl)-1,4-tetramethylenediamine, N,N'-bis(3-aminopropyl)butane-1,4-diamine, N1,N4-Bis(3-aminopropyl)-1,4-butanediamine, spermine |
| Substituent Name | Secondary aliphatic amine, Hydrocarbon derivative, Primary amine, Primary aliphatic amine, Aliphatic acyclic compound |
| Esol Class | Highly soluble |
| Functional Groups | CN, CNC |
| Compound Name | Spermine |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 202.216 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 202.216 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 202.34 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Molecular Framework | Aliphatic acyclic compounds |
| Lipinski Rule Of 5 | True |
| Esol | 0.3181548000000004 |
| Inchi | InChI=1S/C10H26N4/c11-5-3-9-13-7-1-2-8-14-10-4-6-12/h13-14H,1-12H2 |
| Smiles | C(CCNCCCN)CNCCCN |
| Nring | 0.0 |
| Np Classifier Biosynthetic Pathway | Alkaloids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Taxonomy Direct Parent | Dialkylamines |
| Np Classifier Superclass | Ornithine alkaloids |
- 1. Outgoing r'ship
FOUND_INto/from Arachis Hypogaea (Plant) Rel Props:Source_db:fooddb_chem_all - 2. Outgoing r'ship
FOUND_INto/from Avena Fatua (Plant) Rel Props:Reference: - 3. Outgoing r'ship
FOUND_INto/from Avena Sativa (Plant) Rel Props:Source_db:cmaup_ingredients;fooddb_chem_all;npass_chem_all - 4. Outgoing r'ship
FOUND_INto/from Cannabis Sativa (Plant) Rel Props:Reference: - 5. Outgoing r'ship
FOUND_INto/from Capparis Angulata (Plant) Rel Props:Reference: - 6. Outgoing r'ship
FOUND_INto/from Capparis Aphylla (Plant) Rel Props:Reference: - 7. Outgoing r'ship
FOUND_INto/from Capparis Cartilaginea (Plant) Rel Props:Reference: - 8. Outgoing r'ship
FOUND_INto/from Capparis Corundas (Plant) Rel Props:Reference: - 9. Outgoing r'ship
FOUND_INto/from Capparis Decidua (Plant) Rel Props:Reference: - 10. Outgoing r'ship
FOUND_INto/from Capparis Deciduas (Plant) Rel Props:Reference: - 11. Outgoing r'ship
FOUND_INto/from Capparis Divaricata (Plant) Rel Props:Reference: - 12. Outgoing r'ship
FOUND_INto/from Capparis Flavicans (Plant) Rel Props:Reference: - 13. Outgoing r'ship
FOUND_INto/from Capparis Grandis (Plant) Rel Props:Reference: - 14. Outgoing r'ship
FOUND_INto/from Capparis Masaikai (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 15. Outgoing r'ship
FOUND_INto/from Capparis Moonii (Plant) Rel Props:Reference: - 16. Outgoing r'ship
FOUND_INto/from Capparis Olacifolia (Plant) Rel Props:Reference: - 17. Outgoing r'ship
FOUND_INto/from Capparis Rheedii (Plant) Rel Props:Reference: - 18. Outgoing r'ship
FOUND_INto/from Capparis Rotundifolia (Plant) Rel Props:Reference: - 19. Outgoing r'ship
FOUND_INto/from Capparis Roxburghii (Plant) Rel Props:Reference: - 20. Outgoing r'ship
FOUND_INto/from Capparis Sepiaria (Plant) Rel Props:Reference: - 21. Outgoing r'ship
FOUND_INto/from Capparis Spinosa (Plant) Rel Props:Reference: - 22. Outgoing r'ship
FOUND_INto/from Capparis Zeylanica (Plant) Rel Props:Reference: - 23. Outgoing r'ship
FOUND_INto/from Castanea Sativa (Plant) Rel Props:Reference: - 24. Outgoing r'ship
FOUND_INto/from Coffea Arabica (Plant) Rel Props:Source_db:fooddb_chem_all - 25. Outgoing r'ship
FOUND_INto/from Crataeva Magna (Plant) Rel Props:Reference: - 26. Outgoing r'ship
FOUND_INto/from Daucus Carota (Plant) Rel Props:Reference: - 27. Outgoing r'ship
FOUND_INto/from Dioscorea Sativa (Plant) Rel Props:Reference: - 28. Outgoing r'ship
FOUND_INto/from Eruca Sativa (Plant) Rel Props:Reference: - 29. Outgoing r'ship
FOUND_INto/from Eruca Vesicaria (Plant) Rel Props:Reference: - 30. Outgoing r'ship
FOUND_INto/from Glycine Max (Plant) Rel Props:Source_db:fooddb_chem_all - 31. Outgoing r'ship
FOUND_INto/from Heliotropium Indicum (Plant) Rel Props:Reference:https://doi.org/10.1093/database/bav075 - 32. Outgoing r'ship
FOUND_INto/from Hordeum Vulgare (Plant) Rel Props:Source_db:fooddb_chem_all - 33. Outgoing r'ship
FOUND_INto/from Lablab Purpureus (Plant) Rel Props:Source_db:fooddb_chem_all - 34. Outgoing r'ship
FOUND_INto/from Lactuca Sativa (Plant) Rel Props:Reference: - 35. Outgoing r'ship
FOUND_INto/from Lathyrus Sativus (Plant) Rel Props:Source_db:fooddb_chem_all - 36. Outgoing r'ship
FOUND_INto/from Malus Domestica (Plant) Rel Props:Source_db:fooddb_chem_all - 37. Outgoing r'ship
FOUND_INto/from Matricaria Chamomilla (Plant) Rel Props:Reference:https://www.ncbi.nlm.nih.gov/pubmed/11824584 - 38. Outgoing r'ship
FOUND_INto/from Medicago Sativa (Plant) Rel Props:Reference: - 39. Outgoing r'ship
FOUND_INto/from Nectandra Pichurim (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 40. Outgoing r'ship
FOUND_INto/from Nectandra Rubra (Plant) Rel Props:Reference: - 41. Outgoing r'ship
FOUND_INto/from Nectandra Salicifolia (Plant) Rel Props:Reference: - 42. Outgoing r'ship
FOUND_INto/from Nigella Sativa (Plant) Rel Props:Reference: - 43. Outgoing r'ship
FOUND_INto/from Oryza Sativa (Plant) Rel Props:Reference: - 44. Outgoing r'ship
FOUND_INto/from Panax Ginseng (Plant) Rel Props:Reference:https://www.ncbi.nlm.nih.gov/pubmed/18311067 - 45. Outgoing r'ship
FOUND_INto/from Pastinaca Sativa (Plant) Rel Props:Reference: - 46. Outgoing r'ship
FOUND_INto/from Phaseolus Coccineus (Plant) Rel Props:Source_db:fooddb_chem_all - 47. Outgoing r'ship
FOUND_INto/from Phaseolus Lunatus (Plant) Rel Props:Source_db:fooddb_chem_all - 48. Outgoing r'ship
FOUND_INto/from Phaseolus Vulgaris (Plant) Rel Props:Source_db:fooddb_chem_all - 49. Outgoing r'ship
FOUND_INto/from Picea Abies (Plant) Rel Props:Reference:https://www.ncbi.nlm.nih.gov/pubmed/19706648 - 50. Outgoing r'ship
FOUND_INto/from Pimpinella Magna (Plant) Rel Props:Reference: - 51. Outgoing r'ship
FOUND_INto/from Pisum Sativum (Plant) Rel Props:Source_db:fooddb_chem_all - 52. Outgoing r'ship
FOUND_INto/from Pityrogramma Calomelanos (Plant) Rel Props:Reference: - 53. Outgoing r'ship
FOUND_INto/from Pityrogramma Ebenea (Plant) Rel Props:Reference: - 54. Outgoing r'ship
FOUND_INto/from Pityrogramma Tartarea (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 55. Outgoing r'ship
FOUND_INto/from Psophocarpus Tetragonolobus (Plant) Rel Props:Source_db:fooddb_chem_all - 56. Outgoing r'ship
FOUND_INto/from Raphanus Sativus (Plant) Rel Props:Source_db:fooddb_chem_all - 57. Outgoing r'ship
FOUND_INto/from Trifolium Repens (Plant) Rel Props:Reference:ISBN:9788172363093 - 58. Outgoing r'ship
FOUND_INto/from Vicia Faba (Plant) Rel Props:Source_db:fooddb_chem_all - 59. Outgoing r'ship
FOUND_INto/from Vicia Sativa (Plant) Rel Props:Reference:ISBN:9788172363093 - 60. Outgoing r'ship
FOUND_INto/from Vigna Angularis (Plant) Rel Props:Source_db:fooddb_chem_all - 61. Outgoing r'ship
FOUND_INto/from Vigna Mungo (Plant) Rel Props:Source_db:fooddb_chem_all - 62. Outgoing r'ship
FOUND_INto/from Vigna Radiata (Plant) Rel Props:Source_db:fooddb_chem_all - 63. Outgoing r'ship
FOUND_INto/from Vigna Unguiculata (Plant) Rel Props:Source_db:fooddb_chem_all - 64. Outgoing r'ship
FOUND_INto/from Wisteria Floribunda (Plant) Rel Props:Reference:ISBN:9788172363093 - 65. Outgoing r'ship
FOUND_INto/from Xanthium Strumarium (Plant) Rel Props:Reference:ISBN:9788172363093 - 66. Outgoing r'ship
FOUND_INto/from Zea Mays (Plant) Rel Props:Source_db:fooddb_chem_all - 67. Outgoing r'ship
FOUND_INto/from Ziziphus Sativa (Plant) Rel Props:Reference: