(1R,4R,4aS,10aR)-1,4a-dimethyl-4-oxidanyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid

Systemtic Name: (1R,4R,4aS,10aR)-1,4a-dimethyl-4-oxidanyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid Openeye Name: (1R,4R,4aS,10aR)-4-hydroxy-7-isopropyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid CAS Name: (1R,4R,4aS,10aR)-4-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid IUPAC Name: (1R,4R,4aS,10aR)-4-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid Traditional Name: (1R,4R,4aS,10aR)-4-hydroxy-7-isopropyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid Formula: C20H28O3 MolecularWeight: 316.43452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)C3(C(CC2)C(CCC3O)(C)C(=O)O)C

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)[C@@]3([C@@H](CC2)[C@](CC[C@H]3O)(C)C(=O)O)C

InChI

InChI=1S/C20H28O3/c1-12(2)13-5-7-15-14(11-13)6-8-16-19(3,18(22)23)10-9-17(21)20(15,16)4/h5,7,11-12,16-17,21H,6,8-10H2,1-4H3,(H,22,23)/t16-,17+,19+,20+/m0/s1