3-(2-carboxyethyl)-3,5a-dimethyl-6-(6-methylheptan-2-yl)-1,2,3a,4,5,6,7,8,8a,8b-decahydro-as-indacene-2-carboxylic acid

Systemtic Name: 3-(2-carboxyethyl)-3,5a-dimethyl-6-(6-methylheptan-2-yl)-1,2,3a,4,5,6,7,8,8a,8b-decahydro-as-indacene-2-carboxylic acid Openeye Name: 3-(2-carboxyethyl)-6-(1,5-dimethylhexyl)-3,5a-dimethyl-1,2,3a,4,5,6,7,8,8a,8b-decahydro-as-indacene-2-carboxylic acid CAS Name: 3-(2-carboxyethyl)-3,5a-dimethyl-6-(6-methylheptan-2-yl)-1,2,3a,4,5,6,7,8,8a,8b-decahydro-as-indacene-2-carboxylic acid IUPAC Name: 3-(2-carboxyethyl)-3,5a-dimethyl-6-(6-methylheptan-2-yl)-1,2,3a,4,5,6,7,8,8a,8b-decahydro-as-indacene-2-carboxylic acid Traditional Name: 3-(2-carboxyethyl)-6-(1,5-dimethylhexyl)-3,5a-dimethyl-1,2,3a,4,5,6,7,8,8a,8b-decahydro-as-indacene-2-carboxylic acid Formula: C26H44O4 MolecularWeight: 420.62516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC(C3(C)CCC(=O)O)C(=O)O)C

Isomeric SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC(C3(C)CCC(=O)O)C(=O)O)C

InChI

InChI=1S/C26H44O4/c1-16(2)7-6-8-17(3)19-9-10-20-18-15-22(24(29)30)26(5,14-12-23(27)28)21(18)11-13-25(19,20)4/h16-22H,6-15H2,1-5H3,(H,27,28)(H,29,30)