ANSAMYCIN R-116

Molecular Formula: C₄₃H₅₁N₃O₁₁

InChI: InChI=1/C43H51N3O11/c1-20-14-13-15-21(2)42(53)46-34-33(45-27-16-11-10-12-17-27)32(44)29-30(38(34)51)37(50)25(6)40-31(29)41(52)43(8,57-40)55-19-18-28(54-9)22(3)39(56-26(7)47)24(5)36(49)23(4)35(20)48/h10-20,22-24,28,35-36,39,45,48-50H,44H2,1-9H3/b14-13u,19-18u,21-15u,46-34-

InChIKey: InChIKey=DANTVLQNFDXELS-MZONUYDVBI
SMILES: CC1C=CC=C(C(=O)N=C2C(=C(C3=C4C(=C(C(=C3C2=O)O)C)OC(C4=O)(OC=CC(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)N)NC5=CC=CC=C5)C

Names:
    ANSAMYCIN R-116
    NSC301997
    66781-07-5

Registries:
    PubChem CID 327314
    PubChem ID 148347