[(3S,4aS)-5,6-diacetyloxy-1,1,4a-trimethyl-10-oxidanyl-9-oxidanylidene-7-propan-2-yl-3,4-dihydro-2H-phenanthren-3-yl] ethanoate

Systemtic Name: [(3S,4aS)-5,6-diacetyloxy-1,1,4a-trimethyl-10-oxidanyl-9-oxidanylidene-7-propan-2-yl-3,4-dihydro-2H-phenanthren-3-yl] ethanoate Openeye Name: [(3S,4aS)-5,6-diacetoxy-10-hydroxy-7-isopropyl-1,1,4a-trimethyl-9-oxo-3,4-dihydro-2H-phenanthren-3-yl] acetate CAS Name: acetic acid [(3S,4aS)-5,6-diacetyloxy-10-hydroxy-1,1,4a-trimethyl-9-oxo-7-propan-2-yl-3,4-dihydro-2H-phenanthren-3-yl] ester IUPAC Name: [(3S,4aS)-5,6-diacetyloxy-10-hydroxy-1,1,4a-trimethyl-9-oxo-7-propan-2-yl-3,4-dihydro-2H-phenanthren-3-yl] acetate Traditional Name: acetic acid [(3S,4aS)-5,6-diacetoxy-10-hydroxy-7-isopropyl-9-keto-1,1,4a-trimethyl-3,4-dihydro-2H-phenanthren-3-yl] ester Formula: C26H32O8 MolecularWeight: 472.52748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C2C(=C1)C(=O)C(=C3C2(CC(CC3(C)C)OC(=O)C)C)O)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(C)C1=C(C(=C2C(=C1)C(=O)C(=C3[C@@]2(C[C@H](CC3(C)C)OC(=O)C)C)O)OC(=O)C)OC(=O)C

InChI

InChI=1S/C26H32O8/c1-12(2)17-9-18-19(23(34-15(5)29)22(17)33-14(4)28)26(8)11-16(32-13(3)27)10-25(6,7)24(26)21(31)20(18)30/h9,12,16,31H,10-11H2,1-8H3/t16-,26+/m0/s1