7-[2-methyl-8-(3-methyl-2-oxidanylidene-pentyl)-6-oxidanyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-bis(oxidanyl)heptanoic acid

Systemtic Name: 7-[2-methyl-8-(3-methyl-2-oxidanylidene-pentyl)-6-oxidanyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-bis(oxidanyl)heptanoic acid Openeye Name: 3,5-dihydroxy-7-[6-hydroxy-2-methyl-8-(3-methyl-2-oxo-pentyl)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]heptanoic acid CAS Name: 3,5-dihydroxy-7-[6-hydroxy-2-methyl-8-(3-methyl-2-oxopentyl)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]heptanoic acid IUPAC Name: 3,5-dihydroxy-7-[6-hydroxy-2-methyl-8-(3-methyl-2-oxopentyl)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]heptanoic acid Traditional Name: 3,5-dihydroxy-7-[6-hydroxy-8-(2-keto-3-methyl-pentyl)-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]enanthic acid Formula: C24H38O6 MolecularWeight: 422.55492

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)CC1CC(C=C2C1C(C(C=C2)C)CCC(CC(CC(=O)O)O)O)O

Isomeric SMILES

CCC(C)C(=O)CC1CC(C=C2C1C(C(C=C2)C)CCC(CC(CC(=O)O)O)O)O

InChI

InChI=1S/C24H38O6/c1-4-14(2)22(28)11-17-10-19(26)9-16-6-5-15(3)21(24(16)17)8-7-18(25)12-20(27)13-23(29)30/h5-6,9,14-15,17-21,24-27H,4,7-8,10-13H2,1-3H3,(H,29,30)