(4bS,8aS)-4b,8,8-trimethyl-1-oxidanyl-2-prop-2-enyl-5,6,7,8a-tetrahydrophenanthrene-3,4-dione

Systemtic Name: (4bS,8aS)-4b,8,8-trimethyl-1-oxidanyl-2-prop-2-enyl-5,6,7,8a-tetrahydrophenanthrene-3,4-dione Openeye Name: (4bS,8aS)-2-allyl-1-hydroxy-4b,8,8-trimethyl-5,6,7,8a-tetrahydrophenanthrene-3,4-dione CAS Name: (4bS,8aS)-1-hydroxy-4b,8,8-trimethyl-2-prop-2-enyl-5,6,7,8a-tetrahydrophenanthrene-3,4-dione IUPAC Name: (4bS,8aS)-1-hydroxy-4b,8,8-trimethyl-2-prop-2-enyl-5,6,7,8a-tetrahydrophenanthrene-3,4-dione Traditional Name: (4bS,8aS)-2-allyl-1-hydroxy-4b,8,8-trimethyl-5,6,7,8a-tetrahydrophenanthrene-3,4-quinone Formula: C20H24O3 MolecularWeight: 312.40276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC2(C1C=CC3=C2C(=O)C(=O)C(=C3O)CC=C)C)C

Isomeric SMILES

C[C@]12CCCC([C@@H]1C=CC3=C2C(=O)C(=O)C(=C3O)CC=C)(C)C

InChI

InChI=1S/C20H24O3/c1-5-7-13-16(21)12-8-9-14-19(2,3)10-6-11-20(14,4)15(12)18(23)17(13)22/h5,8-9,14,21H,1,6-7,10-11H2,2-4H3/t14-,20-/m0/s1