(4aR,5S,6R,10bS)-10b-methyl-5,6-bis(oxidanyl)-4,4a,5,6,7,8,9,10-octahydro-1H-benzo[h]isochromen-3-one

Systemtic Name: (4aR,5S,6R,10bS)-10b-methyl-5,6-bis(oxidanyl)-4,4a,5,6,7,8,9,10-octahydro-1H-benzo[h]isochromen-3-one Openeye Name: (4aR,5S,6R,10bS)-5,6-dihydroxy-10b-methyl-4,4a,5,6,7,8,9,10-octahydro-1H-benzo[h]isochromen-3-one CAS Name: (4aR,5S,6R,10bS)-5,6-dihydroxy-10b-methyl-4,4a,5,6,7,8,9,10-octahydro-1H-benzo[h][2]benzopyran-3-one IUPAC Name: (4aR,5S,6R,10bS)-5,6-dihydroxy-10b-methyl-4,4a,5,6,7,8,9,10-octahydro-1H-benzo[h]isochromen-3-one Traditional Name: (4aR,5S,6R,10bS)-5,6-dihydroxy-10b-methyl-4,4a,5,6,7,8,9,10-octahydro-1H-benz[h]isochromen-3-one Formula: C14H20O4 MolecularWeight: 252.3062

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Descriptors Computed from Structure

Canonical SMILES:

CC12COC(=O)CC1C(C(C3=C2CCCC3)O)O

Isomeric SMILES

C[C@]12COC(=O)C[C@H]1[C@@H]([C@@H](C3=C2CCCC3)O)O

InChI

InChI=1S/C14H20O4/c1-14-7-18-11(15)6-10(14)13(17)12(16)8-4-2-3-5-9(8)14/h10,12-13,16-17H,2-7H2,1H3/t10-,12+,13-,14+/m0/s1