[(3R,3aS,4S,6E,9R,10S,11E,12aR)-6,10,12a-trimethyl-4-oxidanyl-3-(2-oxidanylpropan-2-yl)-2,3,3a,4,5,8,9,10-octahydro-1H-cyclopenta[11]annulen-9-yl] ethanoate

Systemtic Name: [(3R,3aS,4S,6E,9R,10S,11E,12aR)-6,10,12a-trimethyl-4-oxidanyl-3-(2-oxidanylpropan-2-yl)-2,3,3a,4,5,8,9,10-octahydro-1H-cyclopenta[11]annulen-9-yl] ethanoate Openeye Name: [(3R,3aS,4S,6E,9R,10S,11E,12aR)-4-hydroxy-3-(1-hydroxy-1-methyl-ethyl)-6,10,12a-trimethyl-2,3,3a,4,5,8,9,10-octahydro-1H-cyclopenta[11]annulen-9-yl] acetate CAS Name: acetic acid [(3R,3aS,4S,6E,9R,10S,11E,12aR)-4-hydroxy-3-(2-hydroxypropan-2-yl)-6,10,12a-trimethyl-2,3,3a,4,5,8,9,10-octahydro-1H-cyclopenta[11]annulen-9-yl] ester IUPAC Name: [(3R,3aS,4S,6E,9R,10S,11E,12aR)-4-hydroxy-3-(2-hydroxypropan-2-yl)-6,10,12a-trimethyl-2,3,3a,4,5,8,9,10-octahydro-1H-cyclopenta[11]annulen-9-yl] acetate Traditional Name: acetic acid [(3R,3aS,4S,6E,9R,10S,11E,12aR)-4-hydroxy-3-(1-hydroxy-1-methyl-ethyl)-6,10,12a-trimethyl-2,3,3a,4,5,8,9,10-octahydro-1H-cyclopentacycloundecen-9-yl] ester Formula: C22H36O4 MolecularWeight: 364.51884

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC2(CCC(C2C(CC(=CCC1OC(=O)C)C)O)C(C)(C)O)C

Isomeric SMILES

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

InChI

InChI=1S/C22H36O4/c1-14-7-8-19(26-16(3)23)15(2)9-11-22(6)12-10-17(21(4,5)25)20(22)18(24)13-14/h7,9,11,15,17-20,24-25H,8,10,12-13H2,1-6H3/b11-9+,14-7+/t15-,17+,18-,19+,20+,22-/m0/s1