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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
| Id | http://purl.obolibrary.org/obo/dinto_DB01992
http://purl.obolibrary.org/obo/dinto_DB01992
|
|---|---|
| Preferred Name | coenzyme a |
| Synonyms |
C21H36N7O16P3S
{[(2S,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
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| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| prefLabel | coenzyme a
|
|---|---|
| label | coenzyme a
|
| type | |
| InChIKey | InChIKey=RGJOEKWQDUBAIZ-VPHNIEJBSA-N
|
| Synonym | C21H36N7O16P3S
{[(2S,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
|
| xref |
ChEBI:15346
PubChem Substance:46507023
PubChem Compound:46936280
PDB:COA
ChemSpider:311
Wikipedia:http://en.wikipedia.org/wiki/Coenzyme_A
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| CASRN | 85-61-0
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| prefixIRI | obo2:dinto_DB01992
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| related with |
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| SMILES | CC(C)(CO[P@](O)(=O)O[P@@](O)(=O)OC[C@@H]1O[C@H]([C@H](O)[C@H]1OP(O)(O)=O)N1C=NC2=C1N=CN=C2N)[C@@H](O)C(=O)NCCC(=O)NCCS
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| InChI | InChI=1S/C21H36N7O16P3S/c1-21(2,16(31)19(32)24-4-3-12(29)23-5-6-48)8-41-47(38,39)44-46(36,37)40-7-11-15(43-45(33,34)35)14(30)20(42-11)28-10-27-13-17(22)25-9-26-18(13)28/h9-11,14-16,20,30-31,48H,3-8H2,1-2H3,(H,23,29)(H,24,32)(H,36,37)(H,38,39)(H2,22,25,26)(H2,33,34,35)/t11-,14+,15-,16-,20+/m0/s1
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| subClassOf |
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