6-acetyloxy-5-methoxycarbonyl-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid

Systemtic Name: 6-acetyloxy-5-methoxycarbonyl-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid Openeye Name: 6-acetoxy-7-isopropyl-5-methoxycarbonyl-1,1-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid CAS Name: 6-acetyloxy-5-methoxycarbonyl-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid IUPAC Name: 6-acetyloxy-5-methoxycarbonyl-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid Traditional Name: 6-acetoxy-5-carbomethoxy-7-isopropyl-1,1-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid Formula: C24H32O6 MolecularWeight: 416.50728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)C(=O)OC)OC(=O)C

Isomeric SMILES

CC(C)C1=C(C(=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)C(=O)OC)OC(=O)C

InChI

InChI=1S/C24H32O6/c1-13(2)16-12-15-8-9-17-23(4,5)10-7-11-24(17,22(27)28)19(15)18(21(26)29-6)20(16)30-14(3)25/h12-13,17H,7-11H2,1-6H3,(H,27,28)