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| Formula | C34H36N4O4S |
| Net Charge | 0 |
| Average Mass | 596.753 |
| Monoisotopic Mass | 596.24573 |
| SMILES | [H]O[C@]1([H])[C@@]([H])(O[H])[C@@]([H])(C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])N(C([H])([H])C2([H])C([H])([H])C2([H])[H])C(=O)N(C([H])([H])c2c([H])c([H])c([H])c(C(=O)N([H])c3nc([H])c([H])s3)c2[H])[C@]1([H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H] |
| InChI | InChI=1S/C34H36N4O4S/c39-30-28(19-23-8-3-1-4-9-23)37(21-25-14-15-25)34(42)38(29(31(30)40)20-24-10-5-2-6-11-24)22-26-12-7-13-27(18-26)32(41)36-33-35-16-17-43-33/h1-13,16-18,25,28-31,39-40H,14-15,19-22H2,(H,35,36,41)/t28-,29-,30+,31+/m1/s1 |
| InChIKey | HFLCERPZYCWLSZ-VKONIRKNSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-{[(4R,5S,6S,7R)-4,7-dibenzyl-3-(cyclopropylmethyl)-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl}-N-1,3-thiazol-2-ylbenzamide (CHEBI:40328) is a 1,3-thiazoles (CHEBI:38418) |
| 3-{[(4R,5S,6S,7R)-4,7-dibenzyl-3-(cyclopropylmethyl)-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl}-N-1,3-thiazol-2-ylbenzamide (CHEBI:40328) is a benzamides (CHEBI:22702) |
| 3-{[(4R,5S,6S,7R)-4,7-dibenzyl-3-(cyclopropylmethyl)-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl}-N-1,3-thiazol-2-ylbenzamide (CHEBI:40328) is a diazepanone (CHEBI:46948) |
| 3-{[(4R,5S,6S,7R)-4,7-dibenzyl-3-(cyclopropylmethyl)-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl}-N-1,3-thiazol-2-ylbenzamide (CHEBI:40328) is a ureas (CHEBI:47857) |
| Synonyms | Source |
|---|---|
| 3-{[(4R,5S,6S,7R)-4,7-dibenzyl-3-(cyclopropylmethyl)-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl}-N-1,3-thiazol-2-ylbenzamide | PDBeChem |
| [4R--(1ALPHA,5ALPHA,7BETA)]-3-[(CYCLOPROPHYLMETHYL)HEXAHYDRO-5,6-DIHYDROXY-2-OXO-4,7-BIS(PHENYLMETHYL)-1H-1,3-DIAZEPIN]METHYL-2-THIAZOLYLBENZAMIDE | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| 846 | PDBeChem |