Tetracenomycin C, aminobutyryl derivative

Molecular Formula: C27H26ClNO11


InChI: InChI=1/C27H25NO11.ClH/c1-10(28)6-17(30)39-24-15(37-4)9-16(29)27(35)21(24)22(31)13-7-12-8-14(36-3)19(26(34)38-5)11(2)18(12)23(32)20(13)25(27)33;/h7-10,32,35H,6,28H2,1-5H3;1H/fC27H26NO11.Cl/h28H;1h/q+1;-1

InChIKey: InChIKey=FTVKQYHEOUTFNU-LZPCASHYCS
SMILES: CC1=C(C(=CC2=CC3=C(C(=C12)O)C(=O)C4(C(=O)C=C(C(=C4C3=O)OC(=O)CC(C)[NH3+])OC)O)OC)C(=O)OC.[Cl-]

Names:
    NSC365356
    Tetracenomycin C, aminobutyryl derivative
    1-(4a,6-dihydroxy-2,9-dimethoxy-8-methoxycarbonyl-7-methyl-4,5,12-trioxo-tetracen-1-yl)oxycarbonylpropan-2-ylazanium chloride

Registries:
    PubChem CID 5458866
    PubChem ID 8141486