Erythritol
PubChem CID: 222285
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| Compound Synonyms | ERYTHRITOL, meso-Erythritol, 149-32-6, Phycitol, Erythrit, Mesoerythritol, Phycite, Erythrite, Erythrol, L-Erythritol, (2R,3S)-butane-1,2,3,4-tetrol, Antierythrite, 1,2,3,4-Butanetetrol, (2R,3S)-rel-, erythro-tetritol, Butanetetrol, Erythroglucin, Paycite, C*Eridex, 1,2,3,4-Butanetetrol, i-Erythritol, Tetrahydroxybutane, (2R,3S)-rel-Butane-1,2,3,4-tetraol, CHEBI:17113, NIK 242, Cargill Zerose 16957, Erythritol, meso-, Erythritol [NF], MFCD00004710, (2S,3R)-butane-1,2,3,4-tetrol, UNII-RA96B954X6, CCRIS 7901, 1,2,3,4-Butanetetrol, (R*,S*)-, DTXSID6043919, HSDB 7968, meso-1,2,3,4-Tetrahydroxybutane, RA96B954X6, NSC 8099, NSC-8099, EINECS 205-737-3, ZEROSE TM 16957, INS NO.968, 10030-58-7, DTXCID4023919, FEMA NO. 4819, INS-968, NSC8099, Erythritol (NF), F 8015, Erythrol (VAN), 1,2,3,4-Butanetetrol, (theta,S)-, rel-(2R,3S)-butane-1,2,3,4-tetraol, E-968, ERYTHRITOL (MART.), ERYTHRITOL [MART.], BUTANE-1,2,3,4-TETROL, (2R,3S)-, ERYTHRITOL (USP-RS), ERYTHRITOL [USP-RS], BUTANE 1,2,3,4-TETROL (MESO-ERYTHRITOL), Lichen sugar, ERYTHRITOL (EP IMPURITY), ERYTHRITOL [EP IMPURITY], ERYTHRITOL (EP MONOGRAPH), ERYTHRITOL [EP MONOGRAPH], C4H10O4, MRY, SMR000112220, Erythritol,meso-erythritol, meso-Eythritol, L-(-)-Threitol, (2r,3s)-butane-1,2,3,4-tetraol, D-ERYTHRITOL, (2R,3S)-rel-1,2,3,4-Butanetetrol, ERYTHRITOL [MI], ERYTHRITOL [FCC], WLN: Q1YQYQ1Q, ERYTHRITOL [VANDF], 1,3,4-Tetrahydroxybutane, Epitope ID:114707, meso-Erythritol (Standard), meso-Erythritol, >=99%, SCHEMBL17062, MLS001332365, MLS001332366, CHEMBL349605, HMS2270M08, Pharmakon1600-01301025, meso-Erythritol, analytical standard, Tox21_200564, NSC760400, s4224, 1,3,4-Butanetetrol, (R*,S*)-, AKOS006339851, CCG-266079, DB04481, DS-5851, HY-100551R, ME05658, NSC-760400, NCGC00247033-01, NCGC00258118-01, CAS-149-32-6, E968, E0021, SW219107-1, C00503, D08915, E70403, EN300-1273040, Q421873, BRD-K79315489-001-07-8, BRD-K79315489-001-08-6, F0001-2636, Z1203161930, BDF1567C-B08B-425A-B87F-15FF46328423, Erythritol, European Pharmacopoeia (EP) Reference Standard, Erythritol, United States Pharmacopeia (USP) Reference Standard, Erythritol, Pharmaceutical Secondary Standard, Certified Reference Material, 205-737-3 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 80.9 |
| Hydrogen Bond Donor Count | 4.0 |
| Pfizer 3 75 Rule | True |
| Deep Smiles | OC[C@H][C@H]CO))O))O |
| Heavy Atom Count | 8.0 |
| Classyfire Class | Organooxygen compounds |
| Classyfire Subclass | Carbohydrates and carbohydrate conjugates |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 48.0 |
| Database Name | cmaup_ingredients;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 2.0 |
| Uniprot Id | P00811, P37840, n.a., P0DTD1 |
| Iupac Name | (2S,3R)-butane-1,2,3,4-tetrol |
| Prediction Hob | 1.0 |
| Class | Organooxygen compounds |
| Veber Rule | True |
| Classyfire Superclass | Organic oxygen compounds |
| Xlogp | -2.3 |
| Superclass | Organic oxygen compounds |
| Subclass | Carbohydrates and carbohydrate conjugates |
| Gsk 4 400 Rule | True |
| Molecular Formula | C4H10O4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | UNXHWFMMPAWVPI-ZXZARUISSA-N |
| Silicos It Class | Soluble |
| Fcsp3 | 1.0 |
| Logs | 0.356 |
| Rotatable Bond Count | 3.0 |
| State | Solid |
| Logd | -2.088 |
| Synonyms | (2R,3S)-Butane-1,2,3,4-tetrol, Erythrit, Erythrite, Erythro-tetritol, Erythrol, L-Erythritol, MESO-erythritol, Mesoerythritol, Phycite, Phycitol, 1,2,3,4-Butanetetrol, Antierythrite, Butanetetrol, C*Eridex, Erythroglucin, I-erythritol, L-(-)-Threitol, L-Threitol, Lichen sugar, Meso-eythritol, Paycite, Tetrahydroxybutane, 1,2,3,4-Tetrahydroxybutane, erythritol |
| Esol Class | Highly soluble |
| Functional Groups | CO |
| Compound Name | Erythritol |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 122.058 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 122.058 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 122.12 |
| Gi Absorption | False |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Molecular Framework | Aliphatic acyclic compounds |
| Lipinski Rule Of 5 | True |
| Esol | 1.0435560000000002 |
| Inchi | InChI=1S/C4H10O4/c5-1-3(7)4(8)2-6/h3-8H,1-2H2/t3-,4+ |
| Smiles | C([C@H]([C@H](CO)O)O)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | False |
| Taxonomy Direct Parent | Sugar alcohols |
- 1. Outgoing r'ship
FOUND_INto/from Allium Chinense (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Allium Macrostemon (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Aloe Microstigma (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 4. Outgoing r'ship
FOUND_INto/from Ambroma Augusta (Plant) Rel Props:Reference:ISBN:9788172362089 - 5. Outgoing r'ship
FOUND_INto/from Anethum Graveolens (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 6. Outgoing r'ship
FOUND_INto/from Anethum Sowa (Plant) Rel Props:Reference:ISBN:9788171360536 - 7. Outgoing r'ship
FOUND_INto/from Arabidopsis Thaliana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 8. Outgoing r'ship
FOUND_INto/from Artemisia Dracunculus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 9. Outgoing r'ship
FOUND_INto/from Astilbe Koreana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 10. Outgoing r'ship
FOUND_INto/from Boronia Muelleri (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 11. Outgoing r'ship
FOUND_INto/from Carum Carvi (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 12. Outgoing r'ship
FOUND_INto/from Cassia Carnaval (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 13. Outgoing r'ship
FOUND_INto/from Chrozophora Prostrata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 14. Outgoing r'ship
FOUND_INto/from Citrullus Lanatus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 15. Outgoing r'ship
FOUND_INto/from Colchicum Macedonicum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 16. Outgoing r'ship
FOUND_INto/from Coprosma Acerosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 17. Outgoing r'ship
FOUND_INto/from Coptis Deltoidea (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 18. Outgoing r'ship
FOUND_INto/from Cranfillia Vulcanica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 19. Outgoing r'ship
FOUND_INto/from Dalbergia Frutescens (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 20. Outgoing r'ship
FOUND_INto/from Delonix Regia (Plant) Rel Props:Reference:ISBN:9770972795006 - 21. Outgoing r'ship
FOUND_INto/from Dicliptera Riparia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 22. Outgoing r'ship
FOUND_INto/from Dillenia Papuana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 23. Outgoing r'ship
FOUND_INto/from Erythrina Variegata (Plant) Rel Props:Reference:ISBN:9770972795006; ISBN:9788172362300; ISBN:9788185042145 - 24. Outgoing r'ship
FOUND_INto/from Euphorbia Caducifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 25. Outgoing r'ship
FOUND_INto/from Ficus Elastica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 26. Outgoing r'ship
FOUND_INto/from Glehnia Littoralis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 27. Outgoing r'ship
FOUND_INto/from Gymnema Montanum (Plant) Rel Props:Reference:ISBN:9770972795006 - 28. Outgoing r'ship
FOUND_INto/from Hypericum Papuanum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 29. Outgoing r'ship
FOUND_INto/from Ilex Kaushue (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 30. Outgoing r'ship
FOUND_INto/from Inula Thapsoides (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 31. Outgoing r'ship
FOUND_INto/from Kaunia Arbuscularis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 32. Outgoing r'ship
FOUND_INto/from Limeum Pterocarpum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 33. Outgoing r'ship
FOUND_INto/from Lupinus Formosus (Plant) Rel Props:Source_db:npass_chem_all - 34. Outgoing r'ship
FOUND_INto/from Oxandra Xylopioides (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 35. Outgoing r'ship
FOUND_INto/from Palicourea Alpina (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 36. Outgoing r'ship
FOUND_INto/from Papaver Somniferum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 37. Outgoing r'ship
FOUND_INto/from Parkinsonia Aculeata (Plant) Rel Props:Reference:ISBN:9788185042114 - 38. Outgoing r'ship
FOUND_INto/from Persicaria Thunbergii (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 39. Outgoing r'ship
FOUND_INto/from Pimpinella Thelungiana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 40. Outgoing r'ship
FOUND_INto/from Pinellia Pedatisecta (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 41. Outgoing r'ship
FOUND_INto/from Posoqueria Latifolia (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 42. Outgoing r'ship
FOUND_INto/from Primula Malacoides (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 43. Outgoing r'ship
FOUND_INto/from Rhodomyrtus Tomentosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 44. Outgoing r'ship
FOUND_INto/from Salix Sieboldiana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 45. Outgoing r'ship
FOUND_INto/from Salvia Xalapensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 46. Outgoing r'ship
FOUND_INto/from Sambucus Ebulus (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 47. Outgoing r'ship
FOUND_INto/from Scrophularia Smithii (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 48. Outgoing r'ship
FOUND_INto/from Scutellaria Barbata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 49. Outgoing r'ship
FOUND_INto/from Senna Alata (Plant) Rel Props:Reference:ISBN:9770972795006 - 50. Outgoing r'ship
FOUND_INto/from Sesbania Sesban (Plant) Rel Props:Reference:ISBN:9788185042145 - 51. Outgoing r'ship
FOUND_INto/from Solanum Torvum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 52. Outgoing r'ship
FOUND_INto/from Tanacetum Santolinoides (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 53. Outgoing r'ship
FOUND_INto/from Trifolium Alexandrium (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 54. Outgoing r'ship
FOUND_INto/from Trifolium Pratense (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 55. Outgoing r'ship
FOUND_INto/from Tylophora Flava (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 56. Outgoing r'ship
FOUND_INto/from Wunderlichia Mirabilis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 57. Outgoing r'ship
FOUND_INto/from Zilla Spinosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 58. Outgoing r'ship
FOUND_INto/from Zingiber Officinale (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all