(4aS)-1,2,4a-trimethyl-5,6,8-tris(oxidanyl)-7-prop-2-enyl-4H-phenanthrene-3,9-dione

Systemtic Name: (4aS)-1,2,4a-trimethyl-5,6,8-tris(oxidanyl)-7-prop-2-enyl-4H-phenanthrene-3,9-dione Openeye Name: (4aS)-7-allyl-5,6,8-trihydroxy-1,2,4a-trimethyl-4H-phenanthrene-3,9-dione CAS Name: (4aS)-5,6,8-trihydroxy-1,2,4a-trimethyl-7-prop-2-enyl-4H-phenanthrene-3,9-dione IUPAC Name: (4aS)-5,6,8-trihydroxy-1,2,4a-trimethyl-7-prop-2-enyl-4H-phenanthrene-3,9-dione Traditional Name: (4aS)-7-allyl-5,6,8-trihydroxy-1,2,4a-trimethyl-4H-phenanthrene-3,9-quinone Formula: C20H20O5 MolecularWeight: 340.3698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=O)C3=C(C2(CC1=O)C)C(=C(C(=C3O)CC=C)O)O)C

Isomeric SMILES

CC1=C(C2=CC(=O)C3=C([C@]2(CC1=O)C)C(=C(C(=C3O)CC=C)O)O)C

InChI

InChI=1S/C20H20O5/c1-5-6-11-17(23)15-13(21)7-12-9(2)10(3)14(22)8-20(12,4)16(15)19(25)18(11)24/h5,7,23-25H,1,6,8H2,2-4H3/t20-/m0/s1