N-Trifluoroacetyladriamycin-14-O-hemiadipate

Molecular Formula: C₃₅H₃₆F₃NO₁₅

InChI: InChI=1/C35H36F3NO15/c1-14-28(44)17(39-33(49)35(36,37)38)10-23(53-14)54-19-12-34(50,20(40)13-52-22(43)9-4-3-8-21(41)42)11-16-25(19)32(48)27-26(30(16)46)29(45)15-6-5-7-18(51-2)24(15)31(27)47/h5-7,14,17,19,23,28,44,46,48,50H,3-4,8-13H2,1-2H3,(H,39,49)(H,41,42)/f/h39,41H

InChIKey: InChIKey=WWEOUUXDYBGPLE-BASFAYMICG
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)CCCCC(=O)O)O)NC(=O)C(F)(F)F)O

Names:
    AD 143
    AD143
    BRN 5710766
    Hexanedioic acid, mono(2-(1,2,3,4,6,11-hexahydro-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-4-((2,3,6-trideoxy-3-((trifluoroacetyl)amino)-alpha-L-lyxo-hexopyranosyl)oxy)-2-naphthacenyl)ethyl) ester, (2S-cis)- (9CI)
    Hexanedioic acid, mono(2-(1,2,3,4,6,11-hexahydro-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-4-((2,3,6-trideoxy-3-((trifluoroacetyl)amino)-alpha-L-lyxo-hexopyranosyl)oxy)-2-naphthacenyl)-2-oxoethyl) ester, (2S-cis)-
    NSC 336379
    N-Trifluoroacetyladriamycin-14-O-hemiadipate
    5,12-Naphthacenedione, 7,8,9,10-tetrahydro-8-(hydroxyacetyl)-1-methoxy-10-((2,3,6-trideoxy-3-(trifluoroacetamido)-alpha-L-lyxo-hexopyranosyl)oxy)-6,8,11-trihydroxy-, 8-adipate (1:1), (8S-cis)-
    6-oxo-6-[2-oxo-2-[2,5,12-trihydroxy-4-[5-hydroxy-6-methyl-4-[(2,2,2-trifluoroacetyl)amino]oxan-2-yl]oxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]ethoxy]hexanoic acid
    80787-29-7
    99759-63-4

Registries:
    PubChem CID 3034108
    PubChem ID 215786