methyl (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetyloxy-1,4a,7-trimethyl-7-[(3-oxidanyl-5-oxidanylidene-oxolan-3-yl)methyl]-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate

Systemtic Name: methyl (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetyloxy-1,4a,7-trimethyl-7-[(3-oxidanyl-5-oxidanylidene-oxolan-3-yl)methyl]-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate Openeye Name: methyl (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-[(3-hydroxy-5-oxo-tetrahydrofuran-3-yl)methyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate CAS Name: (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetyloxy-7-[(3-hydroxy-5-oxo-3-oxolanyl)methyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester IUPAC Name: methyl (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetyloxy-7-[(3-hydroxy-5-oxooxolan-3-yl)methyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate Traditional Name: (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-[(3-hydroxy-5-keto-tetrahydrofuran-3-yl)methyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester Formula: C26H40O7 MolecularWeight: 464.5916

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C2CCC3C(C2CCC1(C)CC4(CC(=O)OC4)O)(CCCC3(C)C(=O)OC)C

Isomeric SMILES

CC(=O)O[C@H]1[C@@H]2CC[C@@H]3[C@@]([C@H]2CC[C@]1(C)CC4(CC(=O)OC4)O)(CCC[C@@]3(C)C(=O)OC)C

InChI

InChI=1S/C26H40O7/c1-16(27)33-21-17-7-8-19-24(3,10-6-11-25(19,4)22(29)31-5)18(17)9-12-23(21,2)14-26(30)13-20(28)32-15-26/h17-19,21,30H,6-15H2,1-5H3/t17-,18+,19-,21+,23-,24-,25-,26?/m1/s1