(3S,4S,12bS)-4-(hydroxymethyl)-8,11-dimethoxy-12b-methyl-3,5-bis(oxidanyl)-1,2,3,4-tetrahydrobenzo[a]anthracen-6-one

Systemtic Name: (3S,4S,12bS)-4-(hydroxymethyl)-8,11-dimethoxy-12b-methyl-3,5-bis(oxidanyl)-1,2,3,4-tetrahydrobenzo[a]anthracen-6-one Openeye Name: (3S,4S,12bS)-3,5-dihydroxy-4-(hydroxymethyl)-8,11-dimethoxy-12b-methyl-1,2,3,4-tetrahydrobenzo[a]anthracen-6-one CAS Name: (3S,4S,12bS)-3,5-dihydroxy-4-(hydroxymethyl)-8,11-dimethoxy-12b-methyl-1,2,3,4-tetrahydrobenzo[a]anthracen-6-one IUPAC Name: (3S,4S,12bS)-3,5-dihydroxy-4-(hydroxymethyl)-8,11-dimethoxy-12b-methyl-1,2,3,4-tetrahydrobenzo[a]anthracen-6-one Traditional Name: (3S,4S,12bS)-3,5-dihydroxy-8,11-dimethoxy-12b-methyl-4-methylol-1,2,3,4-tetrahydrobenz[a]anthracen-6-one Formula: C22H24O6 MolecularWeight: 384.42236

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(C(C1=C(C(=O)C3=CC4=C(C=CC(=C4C=C23)OC)OC)O)CO)O

Isomeric SMILES

C[C@@]12CC[C@@H]([C@@H](C1=C(C(=O)C3=CC4=C(C=CC(=C4C=C23)OC)OC)O)CO)O

InChI

InChI=1S/C22H24O6/c1-22-7-6-16(24)14(10-23)19(22)21(26)20(25)13-8-11-12(9-15(13)22)18(28-3)5-4-17(11)27-2/h4-5,8-9,14,16,23-24,26H,6-7,10H2,1-3H3/t14-,16-,22-/m0/s1