N-Desacetyl-N-adamantoyl-thiocolchicine

Molecular Formula: C31H37NO5S


InChI: InChI=1/C31H37NO5S/c1-35-25-12-20-5-7-23(32-30(34)31-14-17-9-18(15-31)11-19(10-17)16-31)22-13-24(33)26(38-4)8-6-21(22)27(20)29(37-3)28(25)36-2/h6,8,12-13,17-19,23H,5,7,9-11,14-16H2,1-4H3,(H,32,34)/t17?,18?,19?,23-,31?/m0/s1/f/h32H

InChIKey: InChIKey=XZCAOCHCMOFVSD-DMIUPSEMDE
SMILES: COC1=C(C(=C2C(=C1)CCC(C3=CC(=O)C(=CC=C32)SC)NC(=O)C45CC6CC(C4)CC(C6)C5)OC)OC

Names:
    N-Desacetyl-N-adamantoyl-thiocolchicine [French]
    N-Desacetyl-N-adamantoyl-thiocolchicine
    Tricyclo(3.3.1.1(sup 3,7))decane-1-carboxamide, N-(5,6,7,9-tetrahydro-1,2,3-trimethoxy-10-(methylthio)-9-oxobenzo(a)heptalen-7-yl)-
    60864-99-5

Registries:
    PubChem CID 64414
    PubChem ID 206387