Adriamycin nicotinate

Molecular Formula: C₃₃H₃₂N₂O₁₂

InChI: InChI=1/C33H32N2O12/c1-14-27(37)18(34)9-22(46-14)47-20-11-33(43,21(36)13-45-32(42)15-5-4-8-35-12-15)10-17-24(20)31(41)26-25(29(17)39)28(38)16-6-3-7-19(44-2)23(16)30(26)40/h3-8,12,14,18,20,22,27,37,39,41,43H,9-11,13,34H2,1-2H3

InChIKey: InChIKey=XNPXCAQTDHPAQC-UHFFFAOYAJ
SMILES: CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)COC(=O)C6=CN=CC=C6)O)N)O

Names:
    Adriamycin nicotinate
    Adriamycin, 14-nicotinate, monohydrochloride
    NSC149583
    3-Pyridinecarboxylic acid, 2-[4-[ (3-amino-2,3, 6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-1,2,3,4,6, 11-hexahydro-2,5,12-trihydroxy-7-methoxy-6, 11-dioxo-2-naphthacenyl]-2-oxoethyl ester, monohydrochloride, (2S-cis)- (9CI) (MF1)
    51898-40-9
    [2-[4-(4-amino-5-hydroxy-6-methyl-oxan-2-yl)oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxo-ethyl] pyridine-3-carboxylate

Registries:
    PubChem CID 422929
    PubChem ID 560199