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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
| Id | http://purl.obolibrary.org/obo/dinto_DB02432
http://purl.obolibrary.org/obo/dinto_DB02432
|
|---|---|
| Preferred Name | ru90395 |
| Synonyms |
C35H36FN3O9
2-{4-[(2R)-2-acetamido-2-{[(3R)-2-oxo-1-[(4-phenylphenyl)methyl]azepan-3-yl]carbamoyl}ethyl]-2-(methoxycarbonyl)phenyl}-2-fluoropropanedioic acid
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| prefLabel | ru90395
|
|---|---|
| label | ru90395
|
| type | |
| InChIKey | InChIKey=RLLAUERCSKPFGD-FQLXRVMXSA-N
|
| Synonym | C35H36FN3O9
2-{4-[(2R)-2-acetamido-2-{[(3R)-2-oxo-1-[(4-phenylphenyl)methyl]azepan-3-yl]carbamoyl}ethyl]-2-(methoxycarbonyl)phenyl}-2-fluoropropanedioic acid
|
| xref |
BindingDB:14692
PubChem Compound:46936380
PubChem Substance:46506689
ChemSpider:20016477
PDB:903
|
| prefixIRI | obo2:dinto_DB02432
|
| related with | |
| SMILES | COC(=O)C1=CC(C[C@@H](NC(C)=O)C(=O)N[C@@H]2CCCCN(CC3=CC=C(C=C3)C3=CC=CC=C3)C2=O)=CC=C1C(F)(C(O)=O)C(O)=O
|
| InChI | InChI=1S/C35H36FN3O9/c1-21(40)37-29(19-23-13-16-27(26(18-23)32(43)48-2)35(36,33(44)45)34(46)47)30(41)38-28-10-6-7-17-39(31(28)42)20-22-11-14-25(15-12-22)24-8-4-3-5-9-24/h3-5,8-9,11-16,18,28-29H,6-7,10,17,19-20H2,1-2H3,(H,37,40)(H,38,41)(H,44,45)(H,46,47)/t28-,29-/m1/s1
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| subClassOf |
| Delete | Subject | Author | Type | Created |
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