ACETYL PYRIDINE ADENINE DINUCLEOTIDE, REDUCED

Molecular Formula: C22H32N6O14P2


InChI: InChI=1/C22H32N6O14P2/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/h2,4-5,8-10,12-13,15-18,21-22,29-33H,3,6-7H2,1H3,(H,34,35)(H,36,37)(H2,23,24,25)/t10?,12-,13-,15-,16-,17-,18-,21-,22-/m1/s1/f/h34,36H,23H2

InChIKey: InChIKey=APPJAZKWQWZFMO-UMLWIADDDV
SMILES: CC(C1=CN(C=CC1)C2C(C(C(O2)COP(=O)(O)OP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C4N=CN=C5N)O)O)O)O)O

Names:
    ACETYL PYRIDINE ADENINE DINUCLEOTIDE, REDUCED
    AP0
    [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-[3-(1-hydroxyethyl)-4H-pyridin-1-yl]oxolan-2-yl]methoxy]phosphinic acid

Registries:
    PubChem CID 5494408
    PubChem ID 8149064