The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

Id	http://purl.obolibrary.org/obo/dinto_DB03070 http://purl.obolibrary.org/obo/dinto_DB03070
Preferred Name	selenazole-4-carboxyamide-adenine dinucleotide
Synonyms	[({[(2S,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]({[(2S,3R,4R,5R)-5-(4-carbamoyl-1,3-selenazol-2-yl)-3,4-dihydroxyoxolan-2-yl]methoxy})phosphinic acid C19H25N7O14P2Se
Type	http://www.w3.org/2002/07/owl#Class

prefLabel	selenazole-4-carboxyamide-adenine dinucleotide
label	selenazole-4-carboxyamide-adenine dinucleotide
type	http://www.w3.org/2002/07/owl#Class
InChIKey	InChIKey=SKNBJMQZTZPCPF-FXXOXGJPSA-N
Synonym	[({[(2S,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]({[(2S,3R,4R,5R)-5-(4-carbamoyl-1,3-selenazol-2-yl)-3,4-dihydroxyoxolan-2-yl]methoxy})phosphinic acid C19H25N7O14P2Se
xref	PubChem Substance:46508188 PDB:SAE PubChem Compound:46936569
prefixIRI	obo2:dinto_DB03070
related with	http://purl.obolibrary.org/obo/dinto_3446
SMILES	NC(=O)C1=C[Se]C(=N1)[C@@H]1O[C@@H](CO[P@](O)(=O)O[P@@](O)(=O)OC[C@@H]2O[C@H]([C@H](O)[C@H]2O)N2C=NC3=C2N=CN=C3N)[C@H](O)[C@H]1O
InChI	InChI=1S/C19H25N7O14P2Se/c20-15-9-17(23-4-22-15)26(5-24-9)19-13(30)11(28)8(39-19)2-37-42(34,35)40-41(32,33)36-1-7-10(27)12(29)14(38-7)18-25-6(3-43-18)16(21)31/h3-5,7-8,10-14,19,27-30H,1-2H2,(H2,21,31)(H,32,33)(H,34,35)(H2,20,22,23)/t7-,8-,10-,11-,12+,13+,14+,19+/m0/s1
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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