OntologieschebiclassesCHEBI:57945   
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NADH(2-)
http://purl.obolibrary.org/obo/CHEBI_57945

Dianion of NADH arising from deprotonation of the two diphosphate OH groups; major species at pH 7.3.

Also appears inzpslmgouphenooba
Exact Synonyms
adenosine 5'-{3-[1-(3-carbamoyl-1,4-dihydropyridin-1-yl)-1,4-anhydro-D-ribitol-5-yl] diphosphate}
Related Synonyms
NADH dianion
NADH
class Information
charge

-2

formula

C21H27N7O14P2

has_dbxref

Beilstein:3869564

has_obo_namespace

chebi_ontology

inchi

InChI=1S/C21H29N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1,3-4,7-8,10-11,13-16,20-21,29-32H,2,5-6H2,(H2,23,33)(H,34,35)(H,36,37)(H2,22,24,25)/p-2/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1

inchikey

BOPGDPNILDQYTO-NNYOXOHSSA-L

in_subset

3_STAR

mass

663.42510

monoisotopicmass

663.11022

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](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1O

class Relations