CHEBI:77177 - α-NADPH(4−)

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ChEBI Name α-NADPH(4−)
ChEBI ID CHEBI:77177
ChEBI ASCII Name alpha-NADPH(4-)
Definition An organophosphate oxoanion obtained by deprotonation of the phosphate and diphosphate OH groups of α-NADPH; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter KAX
Supplier Information
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Formula C21H26N7O17P3
Net Charge -4
Average Mass 741.39130
Monoisotopic Mass 741.06200
InChI InChI=1S/C21H30N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1,3-4,7-8,10-11,13-16,20-21,29-31H,2,5-6H2,(H2,23,32)(H,36,37)(H,38,39)(H2,22,24,25)(H2,33,34,35)/p-4/t10-,11-,13-,14-,15-,16-,20+,21-/m1/s1
InChIKey ACFIXJIJDZMPPO-OPDHFMQKSA-J
SMILES NC(=O)C1=CN(C=CC1)[C@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](OP([O-])([O-])=O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1O
ChEBI Ontology
Outgoing α-NADPH(4−) (CHEBI:77177) is a organophosphate oxoanion (CHEBI:58945)
α-NADPH(4−) (CHEBI:77177) is conjugate base of α-NADPH (CHEBI:77312)
Incoming α-NADPH (CHEBI:77312) is conjugate acid of α-NADPH(4−) (CHEBI:77177)
Synonym Source
α-NADPH UniProt
Manual Xref Database
CPD-16005 MetaCyc
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Last Modified
08 May 2014