[(1R,2R,3aR,5R,6E,10R,11S,13R,13aS)-1,2,3a,11-tetraacetyloxy-2,5,8,8-tetramethyl-12-methylidene-10-oxidanyl-4,9-bis(oxidanylidene)-3,5,10,11,13,13a-hexahydro-1H-cyclopenta[12]annulen-13-yl] ethanoate

Systemtic Name: [(1R,2R,3aR,5R,6E,10R,11S,13R,13aS)-1,2,3a,11-tetraacetyloxy-2,5,8,8-tetramethyl-12-methylidene-10-oxidanyl-4,9-bis(oxidanylidene)-3,5,10,11,13,13a-hexahydro-1H-cyclopenta[12]annulen-13-yl] ethanoate Openeye Name: [(1R,2R,3aR,5R,6E,10R,11S,13R,13aS)-1,2,3a,11-tetraacetoxy-10-hydroxy-2,5,8,8-tetramethyl-12-methylene-4,9-dioxo-3,5,10,11,13,13a-hexahydro-1H-cyclopenta[12]annulen-13-yl] acetate CAS Name: acetic acid [(1R,2R,3aR,5R,6E,10R,11S,13R,13aS)-1,2,3a,11-tetraacetyloxy-10-hydroxy-2,5,8,8-tetramethyl-12-methylene-4,9-dioxo-3,5,10,11,13,13a-hexahydro-1H-cyclopenta[12]annulen-13-yl] ester IUPAC Name: [(1R,2R,3aR,5R,6E,10R,11S,13R,13aS)-1,2,3a,11-tetraacetyloxy-10-hydroxy-2,5,8,8-tetramethyl-12-methylidene-4,9-dioxo-3,5,10,11,13,13a-hexahydro-1H-cyclopenta[12]annulen-13-yl] acetate Traditional Name: acetic acid [(1R,2R,3aR,5R,6E,10R,11S,13R,13aS)-1,2,3a,11-tetraacetoxy-10-hydroxy-4,9-diketo-2,5,8,8-tetramethyl-12-methylene-3,5,10,11,13,13a-hexahydro-1H-cyclopentacyclododecen-13-yl] ester Formula: C30H40O13 MolecularWeight: 608.6308

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(C(=O)C(C(C(=C)C(C2C(C(CC2(C1=O)OC(=O)C)(C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)O)(C)C

Isomeric SMILES

C[C@@H]1/C=C/C(C(=O)[C@@H]([C@H](C(=C)[C@@H]([C@H]2[C@H]([C@](C[C@@]2(C1=O)OC(=O)C)(C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)O)(C)C

InChI

InChI=1S/C30H40O13/c1-14-11-12-28(8,9)26(38)22(36)24(40-17(4)32)15(2)23(39-16(3)31)21-27(41-18(5)33)29(10,42-19(6)34)13-30(21,25(14)37)43-20(7)35/h11-12,14,21-24,27,36H,2,13H2,1,3-10H3/b12-11+/t14-,21+,22-,23+,24+,27-,29-,30-/m1/s1