Geldanamycin analog

Molecular Formula: C31H42N2O10


InChI: InChI=1/C31H42N2O10/c1-16-12-21-26(36)22(15-23(35)29(21)41-8)33-30(37)17(2)10-9-11-24(39-6)27(43-31(32)38)18(3)14-19(4)28(42-20(5)34)25(13-16)40-7/h9-11,14-16,19,24-25,27-28H,12-13H2,1-8H3,(H2,32,38)(H,33,37)/b11-9+,17-10+,18-14+/f/h33H,32H2

InChIKey: InChIKey=LTXUQEYEMVCPSO-JJCJMEQYDU
SMILES: CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=CC(=O)C(=C(C1)C2=O)OC)C)OC)OC(=O)N)C)C)OC(=O)C)OC

Names:
    Geldanamycin acetate
    Geldanamycin analog
    NSC255107
    30562-36-8
    [(8E,12Z,14E)-10-carbamoyloxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-8,12,14,18,21-pentaen-6-yl] acetate

Registries:
    PubChem CID 5358470
    PubChem ID 138255