(4bS,10R)-3-methoxy-4b,8,8-trimethyl-10-oxidanyl-2-propan-2-yl-5,6,7,10-tetrahydrophenanthrene-1,4-dione

Systemtic Name: (4bS,10R)-3-methoxy-4b,8,8-trimethyl-10-oxidanyl-2-propan-2-yl-5,6,7,10-tetrahydrophenanthrene-1,4-dione Openeye Name: (4bS,10R)-10-hydroxy-2-isopropyl-3-methoxy-4b,8,8-trimethyl-5,6,7,10-tetrahydrophenanthrene-1,4-dione CAS Name: (4bS,10R)-10-hydroxy-3-methoxy-4b,8,8-trimethyl-2-propan-2-yl-5,6,7,10-tetrahydrophenanthrene-1,4-dione IUPAC Name: (4bS,10R)-10-hydroxy-3-methoxy-4b,8,8-trimethyl-2-propan-2-yl-5,6,7,10-tetrahydrophenanthrene-1,4-dione Traditional Name: (4bS,10R)-10-hydroxy-2-isopropyl-3-methoxy-4b,8,8-trimethyl-5,6,7,10-tetrahydrophenanthrene-1,4-quinone Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=O)C2=C(C1=O)C(C=C3C2(CCCC3(C)C)C)O)OC

Isomeric SMILES

CC(C)C1=C(C(=O)C2=C(C1=O)[C@@H](C=C3[C@@]2(CCCC3(C)C)C)O)OC

InChI

InChI=1S/C21H28O4/c1-11(2)14-17(23)15-12(22)10-13-20(3,4)8-7-9-21(13,5)16(15)18(24)19(14)25-6/h10-12,22H,7-9H2,1-6H3/t12-,21+/m1/s1