The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

Id	http://purl.obolibrary.org/obo/dinto_DB01747 http://purl.obolibrary.org/obo/dinto_DB01747
Preferred Name	coprogen
Synonyms	N-[(1S,13S,27S)-18-[(1E)-4-hydroxy-2-methylbut-1-en-1-yl]-22-[(1Z)-4-hydroxy-2-methylbut-1-en-1-yl]-8-methyl-12,29,31-trioxo-11,19$l^{3},21$l^{3},32,33,34$l^{3},35-heptaoxa-5,17,23,28,30-pentaaza-20-ferrahexacyclo[25.2.2.1^{5,20}.1^{6,20}.1^{17,20}.1^{20,23}]pentatriaconta-6(34),7,18,21-tetraen-13-yl]acetamide C35H53FeN6O13
Type	http://www.w3.org/2002/07/owl#Class

prefLabel	coprogen
label	coprogen
type	http://www.w3.org/2002/07/owl#Class
InChIKey	InChIKey=FQIVLXIUJLOKPL-XKSPKKCDSA-N
Synonym	N-[(1S,13S,27S)-18-[(1E)-4-hydroxy-2-methylbut-1-en-1-yl]-22-[(1Z)-4-hydroxy-2-methylbut-1-en-1-yl]-8-methyl-12,29,31-trioxo-11,19$l^{3},21$l^{3},32,33,34$l^{3},35-heptaoxa-5,17,23,28,30-pentaaza-20-ferrahexacyclo[25.2.2.1^{5,20}.1^{6,20}.1^{17,20}.1^{20,23}]pentatriaconta-6(34),7,18,21-tetraen-13-yl]acetamide C35H53FeN6O13
xref	PubChem Compound:46936204 PubChem Substance:46506975 PDB:CPO
CASRN	31418-71-0
prefixIRI	obo2:dinto_DB01747
related with	http://purl.obolibrary.org/obo/dinto_2332
SMILES	CC(=O)N[C@H]1CCCN2O[Fe]345(ON(CCC[C@@H]6NC(=O)[C@H](CCCN(O3)C(\C=C(C)/CCOC1=O)=[O]4)NC6=O)C(\C=C(\C)CCO)=[O]5)[O]=C2\C=C(/C)CCO
InChI	InChI=1S/C35H53N6O13.Fe/c1-23(11-17-42)20-30(45)39(51)14-5-8-27-33(48)38-28(34(49)37-27)9-6-15-40(52)32(47)22-25(3)13-19-54-35(50)29(36-26(4)44)10-7-16-41(53)31(46)21-24(2)12-18-43;/h20-22,27-29,42-43H,5-19H2,1-4H3,(H,36,44)(H,37,49)(H,38,48);/q-3;+3/b23-20-,24-21+,25-22-;/t27-,28-,29-;/m0./s1
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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