Molecule ID: 70697809

IUPAC Name: [(5Z)-4-(2-methoxy-2-oxoacetyl)-5-(2-methoxy-2-oxoethylidene)-7,8-dimethyl-2,13,15-trioxatetracyclo[8.6.1.04,17.012,16]heptadeca-1(17),10,12(16)-trien-9-yl] hexanoate

Description: The molecule is an organic heterotetracyclic compound isolated from the stems of Kadsura matsudai. It has a role as a plant metabolite. It is an organic heterotetracyclic compound, a cyclic ether, a methyl ester, an alpha-ketoester, an enoate ester and a hexanoate ester.

SMILES: CCCCCC(=O)OC1c2cc3c(c4c2C(C(=O)C(=O)OC)(CO4)/C(=C\C(=O)OC)CC(C)C1C)OCO3

SELFIES: [C][C][C][C][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][Branch2][Ring2][N][C][=C][Ring1][=Branch1][C][Branch1][O][C][=Branch1][C][=O][C][=Branch1][C][=O][O][C][Branch1][Branch1][C][O][Ring1][O][/C][=Branch1][Branch2][=C][\C][=Branch1][C][=O][O][C][C][C][Branch1][C][C][C][Ring2][Ring1][#Branch2][C][O][C][O][Ring2][Ring1][O]

InChI: InChI=1S/C28H34O10/c1-6-7-8-9-20(29)38-23-16(3)15(2)10-17(11-21(30)33-4)28(26(31)27(32)34-5)13-35-25-22(28)18(23)12-19-24(25)37-14-36-19/h11-12,15-16,23H,6-10,13-14H2,1-5H3/b17-11-

Molecular Properties:
- Polar Surface Area: 124.0 Ų
- LogP: 4.2