(4aS)-6-methoxy-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,9-tetrahydrophenanthrene-2,9-diol

Systemtic Name: (4aS)-6-methoxy-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,9-tetrahydrophenanthrene-2,9-diol Openeye Name: (4aS)-7-isopropyl-6-methoxy-1,1,4a-trimethyl-2,3,4,9-tetrahydrophenanthrene-2,9-diol CAS Name: (4aS)-6-methoxy-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,9-tetrahydrophenanthrene-2,9-diol IUPAC Name: (4aS)-6-methoxy-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,9-tetrahydrophenanthrene-2,9-diol Traditional Name: (4aS)-7-isopropyl-6-methoxy-1,1,4a-trimethyl-2,3,4,9-tetrahydrophenanthrene-2,9-diol Formula: C21H30O3 MolecularWeight: 330.4611

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C2C(=C1)C(C=C3C2(CCC(C3(C)C)O)C)O)OC

Isomeric SMILES

CC(C)C1=C(C=C2C(=C1)C(C=C3[C@@]2(CCC(C3(C)C)O)C)O)OC

InChI

InChI=1S/C21H30O3/c1-12(2)13-9-14-15(10-17(13)24-6)21(5)8-7-19(23)20(3,4)18(21)11-16(14)22/h9-12,16,19,22-23H,7-8H2,1-6H3/t16?,19?,21-/m1/s1