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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
| Id | http://purl.obolibrary.org/obo/dinto_DB04172
http://purl.obolibrary.org/obo/dinto_DB04172
|
|---|---|
| Preferred Name | [2,4,6-triisopropyl-phenylsulfonyl-l-[3-amidino-phenylalanine]]-piperazine-n'-beta-alanine |
| Synonyms |
3-[(2R)-3-[4-(3-aminopropanoyl)piperazin-1-yl]-3-oxo-2-{[2,4,6-tris(propan-2-yl)benzene]sulfonamido}propyl]benzene-1-carboximidamide
C32H48N6O4S
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| prefLabel | [2,4,6-triisopropyl-phenylsulfonyl-l-[3-amidino-phenylalanine]]-piperazine-n'-beta-alanine
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|---|---|
| label | [2,4,6-triisopropyl-phenylsulfonyl-l-[3-amidino-phenylalanine]]-piperazine-n'-beta-alanine
|
| type | |
| InChIKey | InChIKey=WATXEHGLYJKXOF-MUUNZHRXSA-N
|
| Synonym | 3-[(2R)-3-[4-(3-aminopropanoyl)piperazin-1-yl]-3-oxo-2-{[2,4,6-tris(propan-2-yl)benzene]sulfonamido}propyl]benzene-1-carboximidamide
C32H48N6O4S
|
| xref |
PDB:UKP
PubChem Compound:46936909
BindingDB:23869
PubChem Substance:46507576
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| prefixIRI | obo2:dinto_DB04172
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| related with | |
| SMILES | CC(C)C1=CC(C(C)C)=C(C(=C1)C(C)C)S(=O)(=O)N[C@H](CC1=CC=CC(=C1)C(N)=N)C(=O)N1CCN(CC1)C(=O)CCN
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| InChI | InChI=1S/C32H48N6O4S/c1-20(2)25-18-26(21(3)4)30(27(19-25)22(5)6)43(41,42)36-28(17-23-8-7-9-24(16-23)31(34)35)32(40)38-14-12-37(13-15-38)29(39)10-11-33/h7-9,16,18-22,28,36H,10-15,17,33H2,1-6H3,(H3,34,35)/t28-/m1/s1
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| subClassOf |
| Delete | Subject | Author | Type | Created |
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