The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

Id	http://purl.obolibrary.org/obo/dinto_DB02930 http://purl.obolibrary.org/obo/dinto_DB02930
Preferred Name	phosphothiophosphoric acid-adenylate ester
Synonyms	{[(2S,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[hydroxy({[hydroxy(sulfanyl)phosphoryl]oxy})phosphoryl]oxy})phosphinic acid C10H16N5O12P3S
Type	http://www.w3.org/2002/07/owl#Class

prefLabel	phosphothiophosphoric acid-adenylate ester
label	phosphothiophosphoric acid-adenylate ester
type	http://www.w3.org/2002/07/owl#Class
InChIKey	InChIKey=NLTUCYMLOPLUHL-FCIPNVEPSA-N
Synonym	{[(2S,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[hydroxy({[hydroxy(sulfanyl)phosphoryl]oxy})phosphoryl]oxy})phosphinic acid C10H16N5O12P3S
xref	ChEBI:27575 PDB:AGS PubChem Substance:46507118 PubChem Compound:46936529
prefixIRI	obo2:dinto_DB02930
related with	http://purl.obolibrary.org/obo/dinto_0826 http://purl.obolibrary.org/obo/dinto_0847 http://purl.obolibrary.org/obo/dinto_3499 http://purl.obolibrary.org/obo/dinto_0732 http://purl.obolibrary.org/obo/dinto_1846 http://purl.obolibrary.org/obo/dinto_1842 http://purl.obolibrary.org/obo/dinto_1844 http://purl.obolibrary.org/obo/dinto_0646 See more See less
SMILES	NC1=NC=NC2=C1N=CN2[C@@H]1O[C@@H](CO[P@](O)(=O)O[P@@](O)(=O)O[P@](O)(S)=O)[C@H](O)[C@H]1O
InChI	InChI=1S/C10H16N5O12P3S/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(25-10)1-24-28(18,19)26-29(20,21)27-30(22,23)31/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H,20,21)(H2,11,12,13)(H2,22,23,31)/t4-,6-,7+,10+/m0/s1
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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