Penta-O-acetylgitoxin

Molecular Formula: C51H74O19


InChI: InChI=1/C51H74O19/c1-24-46(67-31(8)56)37(63-27(4)52)20-43(61-24)69-48-26(3)62-44(21-39(48)65-29(6)54)70-47-25(2)60-42(19-38(47)64-28(5)53)68-34-13-15-49(9)33(18-34)11-12-36-35(49)14-16-50(10)45(32-17-41(57)59-23-32)40(66-30(7)55)22-51(36,50)58/h17,24-26,33-40,42-48,58H,11-16,18-23H2,1-10H3

InChIKey: InChIKey=JDYLJSDIEBHXPO-UHFFFAOYAU
SMILES: CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)OC(=O)C)O)C)C)OC(=O)C)OC7CC(C(C(O7)C)OC8CC(C(C(O8)C)OC(=O)C)OC(=O)C)OC(=O)C

Names:
    Carnacid-cor
    Cordoval
    Gitoxin pentaacetate
    Pengitossina [DCIT]
    Pengitoxine [INN-French]
    Pengitoxin [INN]
    Pengitoxin
    Pentaacetylgitoxin
    Pentagit
    Penta-O-acetylgitoxin
    [4-acetyloxy-6-[4-acetyloxy-6-[4-acetyloxy-6-[[16-acetyloxy-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-methyl-oxan-3-yl]oxy-2-methyl-oxan-3-yl]oxy-2-methyl-oxan-3-yl] acetate

Registries:
    PubChem CID 65593
    PubChem ID 207605