EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C32H37N3O5S |
| Net Charge | 0 |
| Average Mass | 575.731 |
| Monoisotopic Mass | 575.24539 |
| SMILES | [H]Oc1c([H])c([H])c([H])c(C(=O)N([H])[C@]([H])(C(=O)[C@@]([H])(O[H])N2C([H])([H])SC(C([H])([H])[H])(C([H])([H])[H])[C@@]2([H])C(=O)N([H])C([H])([H])c2c([H])c([H])c([H])c([H])c2C([H])([H])[H])C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])c1C([H])([H])[H] |
| InChI | InChI=1S/C32H37N3O5S/c1-20-11-8-9-14-23(20)18-33-30(39)28-32(3,4)41-19-35(28)31(40)27(37)25(17-22-12-6-5-7-13-22)34-29(38)24-15-10-16-26(36)21(24)2/h5-16,25,28,31,36,40H,17-19H2,1-4H3,(H,33,39)(H,34,38)/t25-,28+,31+/m0/s1 |
| InChIKey | WPVYXAHRMQZVED-BOBPPRSMSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (4R)-3-[(1R,3S)-1-hydroxy-3-{[(3-hydroxy-2-methylphenyl)carbonyl]amino}-2-oxo-4-phenylbutyl]-5,5-dimethyl-N-(2-methylbenzyl)-1,3-thiazolidine-4-carboxamide (CHEBI:43685) is a thiazolidinecarboxamide (CHEBI:48881) |
| Synonyms | Source |
|---|---|
| 3-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-BENZOYLAMINO)-4-PHENYL-BUTYRYL]-5,5- DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID 2-METHYL-BENZYLAMIDE | PDBeChem |
| (4R)-3-[(1R,3S)-1-hydroxy-3-{[(3-hydroxy-2-methylphenyl)carbonyl]amino}-2-oxo-4-phenylbutyl]-5,5-dimethyl-N-(2-methylbenzyl)-1,3-thiazolidine-4-carboxamide | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| K64 | PDBeChem |