[4b,8,8-trimethyl-1,3,9-tris(oxidanyl)-10-oxidanylidene-2-propan-2-yl-6,7-dihydro-5H-phenanthren-4-yl] ethanoate

Systemtic Name: [4b,8,8-trimethyl-1,3,9-tris(oxidanyl)-10-oxidanylidene-2-propan-2-yl-6,7-dihydro-5H-phenanthren-4-yl] ethanoate Openeye Name: (1,3,9-trihydroxy-2-isopropyl-4b,8,8-trimethyl-10-oxo-6,7-dihydro-5H-phenanthren-4-yl) acetate CAS Name: acetic acid (1,3,9-trihydroxy-4b,8,8-trimethyl-10-oxo-2-propan-2-yl-6,7-dihydro-5H-phenanthren-4-yl) ester IUPAC Name: (1,3,9-trihydroxy-4b,8,8-trimethyl-10-oxo-2-propan-2-yl-6,7-dihydro-5H-phenanthren-4-yl) acetate Traditional Name: acetic acid (1,3,9-trihydroxy-2-isopropyl-10-keto-4b,8,8-trimethyl-6,7-dihydro-5H-phenanthren-4-yl) ester Formula: C22H28O6 MolecularWeight: 388.45412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C2=C(C(=C1O)OC(=O)C)C3(CCCC(C3=C(C2=O)O)(C)C)C)O

Isomeric SMILES

CC(C)C1=C(C2=C(C(=C1O)OC(=O)C)C3(CCCC(C3=C(C2=O)O)(C)C)C)O

InChI

InChI=1S/C22H28O6/c1-10(2)12-15(24)13-14(19(17(12)26)28-11(3)23)22(6)9-7-8-21(4,5)20(22)18(27)16(13)25/h10,24,26-27H,7-9H2,1-6H3