EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C19H20N6O5S3 |
| Net Charge | 0 |
| Average Mass | 508.607 |
| Monoisotopic Mass | 508.06573 |
| SMILES | [H]OC(=O)C1=C(/C([H])=C(/[H])c2sc([H])nc2C([H])([H])[H])C([H])([H])S[C@]([H])([C@@]([H])(C([H])=O)N([H])C(=O)/C(=N\OC([H])([H])[H])c2nc(N([H])[H])sc2[H])N1[H] |
| InChI | InChI=1S/C19H20N6O5S3/c1-9-13(33-8-21-9)4-3-10-6-31-17(24-14(10)18(28)29)11(5-26)22-16(27)15(25-30-2)12-7-32-19(20)23-12/h3-5,7-8,11,17,24H,6H2,1-2H3,(H2,20,23)(H,22,27)(H,28,29)/b4-3-,25-15-/t11-,17-/m1/s1 |
| InChIKey | XCLKPDQELZKNLK-KRRFQGJCSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2R)-2-[(1R)-1-{[(2Z)-2-(2-AMINO-1,3-THIAZOL-4-YL)-2-(METHOXYIMINO)ACETYL]AMINO}-2-OXOETHYL]-5-[(Z)-2-(4-METHYL-1,3-THIAZOL-5-YL)VINYL]-3,6-DIHYDRO-2H-1,3-THIAZINE-4-CARBOXYLIC ACID (CHEBI:49532) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| (2R)-2-[(1R)-1-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-2-oxoethyl]-5-[(Z)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid | PDBeChem |
| (2R)-2-[(1R)-1-{[(2Z)-2-(2-AMINO-1,3-THIAZOL-4-YL)-2-(METHOXYIMINO)ACETYL]AMINO}-2-OXOETHYL]-5-[(Z)-2-(4-METHYL-1,3-THIAZOL-5-YL)VINYL]-3,6-DIHYDRO-2H-1,3-THIAZINE-4-CARBOXYLIC ACID | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| CDS | PDBeChem |