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CHEBI:166858 - ap-NADH

ChEBI IDCHEBI:166858
ChEBI Nameap-NADH
Stars
Last Modified18 November 2020
Submittereladnoor
DownloadsMolfile
FormulaC22H30N6O14P2
Net Charge0
Average Mass664.458
Monoisotopic Mass664.12952
SMILESCC(=O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1
InChIInChI=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
InChIKeyCIWXCGUGRDQCHH-RBEMOOQDSA-N
ChEBI Ontology
Outgoing Relation(s)
ap-NADH (CHEBI:166858) is a organic molecular entity (CHEBI:50860)
Synonym  Source
3-acetyl NADHChEBI