NADH

Chemical Formula:

C₂₁H₂₇N₇O₁₄P₂

Molecular Weight:

663.43 Daltons

Monoisotopic Mass:

665.1247716966999 Daltons

SMILES:

C1(=C(CC=CN1C5(OC(COP(=O)([O-])OP(=O)([O-])OCC2(OC(C(O)C(O)2)N4(C=NC3(C(N)=NC=NC=34))))C(O)C(O)5))C(N)=O)

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

Synonyms

NADH₂
NADH2
dihydrodiphosphopyridine nucleotide
diphosphopyridine nucleotide reduced
dihydronicotinamide adenine dinucleotide
nicotinamide adenine dinucleotide reduced
NAD-reduced
NADH+H+
DPNH
β-NADH

Databases

MetaCyc: NADH

RefMet: NADH

BiGG: nadh

MetaboLights: MTBLC57945

HMDB: HMDB01487

ChemSpider: 10239197

ChEBI: 57945 16908

PubChem (CID): 21604869 439153

CAS: 58-68-4

KEGG: C00004

PDB-CCD: NAI

3DMET: B01127

NIKKAJI: J213.546I

Seed: cpd00004

MetaNetX: MNXM10

PupChem (SID): 3306

KNApSAcK: C00019343

CHEMBL: CHEMBL1234616