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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
| Id | http://purl.obolibrary.org/obo/dinto_DB08019
http://purl.obolibrary.org/obo/dinto_DB08019
|
|---|---|
| Preferred Name | n-{(3r,4s)-4-[(6-amino-4-methylpyridin-2-yl)methyl]pyrrolidin-3-yl}-n'-(3-chlorobenzyl)ethane-1,2-diamine |
| Synonyms |
C20H28ClN5
6-{[(3S,4R)-4-[(2-{[(3-chlorophenyl)methyl]amino}ethyl)amino]pyrrolidin-3-yl]methyl}-4-methylpyridin-2-amine
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| prefLabel | n-{(3r,4s)-4-[(6-amino-4-methylpyridin-2-yl)methyl]pyrrolidin-3-yl}-n'-(3-chlorobenzyl)ethane-1,2-diamine
|
|---|---|
| label | n-{(3r,4s)-4-[(6-amino-4-methylpyridin-2-yl)methyl]pyrrolidin-3-yl}-n'-(3-chlorobenzyl)ethane-1,2-diamine
|
| type | |
| InChIKey | InChIKey=VWCMAGONQJHIJZ-LPHOPBHVSA-N
|
| Synonym | C20H28ClN5
6-{[(3S,4R)-4-[(2-{[(3-chlorophenyl)methyl]amino}ethyl)amino]pyrrolidin-3-yl]methyl}-4-methylpyridin-2-amine
|
| xref |
PubChem Compound:25021186
ChemSpider:24721145
PDB:JI7
PubChem Substance:99444490
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| prefixIRI | obo2:dinto_DB08019
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| related with | |
| SMILES | [H][C@]1(CC2=NC(N)=CC(C)=C2)CNC[C@]1([H])NCCNCC1=CC(Cl)=CC=C1
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| InChI | InChI=1S/C20H28ClN5/c1-14-7-18(26-20(22)8-14)10-16-12-24-13-19(16)25-6-5-23-11-15-3-2-4-17(21)9-15/h2-4,7-9,16,19,23-25H,5-6,10-13H2,1H3,(H2,22,26)/t16-,19-/m0/s1
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| subClassOf |
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