CHEBI:74521 - AcNADH

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ChEBI Name AcNADH
ChEBI ID CHEBI:74521
Definition A dinucleotide that is NADH with the amide group om the nictotinamide ring replaced with an acetyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C22H30N6O14P2
Net Charge 0
Average Mass 664.45290
Monoisotopic Mass 664.12952
InChI InChI=1S/C22H30N6O14P2/c1-10(29)11-3-2-4-27(5-11)21-17(32)15(30)12(40-21)6-38-43(34,35)42-44(36,37)39-7-13-16(31)18(33)22(41-13)28-9-26-14-19(23)24-8-25-20(14)28/h2,4-5,8-9,12-13,15-18,21-22,30-33H,3,6-7H2,1H3,(H,34,35)(H,36,37)(H2,23,24,25)/t12-,13?,15-,16-,17-,18-,21-,22?/m1/s1
InChIKey CIWXCGUGRDQCHH-CXMVDIQUSA-N
SMILES CC(=O)C1=CN(C=CC1)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OCC2OC([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing AcNADH (CHEBI:74521) has functional parent NADH (CHEBI:16908)
AcNADH (CHEBI:74521) has role metabolite (CHEBI:25212)
AcNADH (CHEBI:74521) is a dinucleotide (CHEBI:47885)
Synonym Source
reduced 3-acetylpyridine adenine dinucleotide ChEBI
Last Modified
30 September 2013