(4aS,6aS,6aS,6bR,8aS,10S,12R,12aS,14bS)-10,12-diacetyloxy-9,9-bis(acetyloxymethyl)-6a,6b,12a-trimethyl-2-methylidene-8a-oxidanyl-3,4,5,6,6a,7,8,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid

Systemtic Name: (4aS,6aS,6aS,6bR,8aS,10S,12R,12aS,14bS)-10,12-diacetyloxy-9,9-bis(acetyloxymethyl)-6a,6b,12a-trimethyl-2-methylidene-8a-oxidanyl-3,4,5,6,6a,7,8,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid Openeye Name: (4aS,6aS,6aS,6bR,8aS,10S,12R,12aS,14bS)-10,12-diacetoxy-9,9-bis(acetoxymethyl)-8a-hydroxy-6a,6b,12a-trimethyl-2-methylene-3,4,5,6,6a,7,8,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid CAS Name: (4aS,6aS,6aS,6bR,8aS,10S,12R,12aS,14bS)-10,12-diacetyloxy-9,9-bis(acetyloxymethyl)-8a-hydroxy-6a,6b,12a-trimethyl-2-methylene-3,4,5,6,6a,7,8,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid IUPAC Name: (4aS,6aS,6aS,6bR,8aS,10S,12R,12aS,14bS)-10,12-diacetyloxy-9,9-bis(acetyloxymethyl)-8a-hydroxy-6a,6b,12a-trimethyl-2-methylidene-3,4,5,6,6a,7,8,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid Traditional Name: (4aS,6aS,6aS,6bR,8aS,10S,12R,12aS,14bS)-10,12-diacetoxy-9,9-bis(acetoxymethyl)-8a-hydroxy-6a,6b,12a-trimethyl-2-methylene-3,4,5,6,6a,7,8,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid Formula: C37H52O11 MolecularWeight: 672.80218

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1(C(CC(C2(C1(CCC3(C2CC=C4C3(CCC5(C4CC(=C)CC5)C(=O)O)C)C)O)C)OC(=O)C)OC(=O)C)COC(=O)C

Isomeric SMILES

CC(=O)OCC1([C@H](C[C@H]([C@]2([C@]1(CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(=C)CC5)C(=O)O)C)C)O)C)OC(=O)C)OC(=O)C)COC(=O)C

InChI

InChI=1S/C37H52O11/c1-21-11-12-35(31(42)43)15-13-32(6)26(27(35)17-21)9-10-28-33(32,7)14-16-37(44)34(28,8)29(47-24(4)40)18-30(48-25(5)41)36(37,19-45-22(2)38)20-46-23(3)39/h9,27-30,44H,1,10-20H2,2-8H3,(H,42,43)/t27-,28-,29+,30-,32+,33+,34-,35-,37-/m0/s1