[4-[(E)-3-[2,4-diacetyloxy-3-[(1S,5R,6S)-5-(4-acetyloxyphenyl)-6-[2,4-diacetyloxy-3-(3-methylbut-2-enyl)phenyl]carbonyl-3-methyl-cyclohex-2-en-1-yl]phenyl]-3-oxidanylidene-prop-1-enyl]phenyl] ethanoate

Systemtic Name: [4-[(E)-3-[2,4-diacetyloxy-3-[(1S,5R,6S)-5-(4-acetyloxyphenyl)-6-[2,4-diacetyloxy-3-(3-methylbut-2-enyl)phenyl]carbonyl-3-methyl-cyclohex-2-en-1-yl]phenyl]-3-oxidanylidene-prop-1-enyl]phenyl] ethanoate Openeye Name: [4-[(E)-3-[2,4-diacetoxy-3-[(1S,5R,6S)-5-(4-acetoxyphenyl)-6-[2,4-diacetoxy-3-(3-methylbut-2-enyl)benzoyl]-3-methyl-cyclohex-2-en-1-yl]phenyl]-3-oxo-prop-1-enyl]phenyl] acetate CAS Name: acetic acid [4-[(E)-3-[2,4-diacetyloxy-3-[(1S,5R,6S)-5-(4-acetyloxyphenyl)-6-[[2,4-diacetyloxy-3-(3-methylbut-2-enyl)phenyl]-oxomethyl]-3-methyl-1-cyclohex-2-enyl]phenyl]-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-[2,4-diacetyloxy-3-[(1S,5R,6S)-5-(4-acetyloxyphenyl)-6-[2,4-diacetyloxy-3-(3-methylbut-2-enyl)benzoyl]-3-methylcyclohex-2-en-1-yl]phenyl]-3-oxoprop-1-enyl]phenyl] acetate Traditional Name: acetic acid [4-[(E)-3-[2,4-diacetoxy-3-[(1S,5R,6S)-5-(4-acetoxyphenyl)-6-[2,4-diacetoxy-3-(3-methylbut-2-enyl)benzoyl]-3-methyl-cyclohex-2-en-1-yl]phenyl]-3-keto-prop-1-enyl]phenyl] ester Formula: C52H50O14 MolecularWeight: 898.945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(C(C1)C2=CC=C(C=C2)OC(=O)C)C(=O)C3=C(C(=C(C=C3)OC(=O)C)CC=C(C)C)OC(=O)C)C4=C(C=CC(=C4OC(=O)C)C(=O)C=CC5=CC=C(C=C5)OC(=O)C)OC(=O)C

Isomeric SMILES

CC1=C[C@@H]([C@H]([C@@H](C1)C2=CC=C(C=C2)OC(=O)C)C(=O)C3=C(C(=C(C=C3)OC(=O)C)CC=C(C)C)OC(=O)C)C4=C(C=CC(=C4OC(=O)C)C(=O)/C=C/C5=CC=C(C=C5)OC(=O)C)OC(=O)C

InChI

InChI=1S/C52H50O14/c1-28(2)10-20-41-46(63-32(6)55)24-22-42(51(41)65-34(8)57)50(60)48-43(37-14-18-39(19-15-37)62-31(5)54)26-29(3)27-44(48)49-47(64-33(7)56)25-21-40(52(49)66-35(9)58)45(59)23-13-36-11-16-38(17-12-36)61-30(4)53/h10-19,21-25,27,43-44,48H,20,26H2,1-9H3/b23-13+/t43-,44-,48-/m0/s1