3-methoxycarbonyl-2,2,3,4,5,5-hexamethyl-4-[(2-methylpropan-2-yl)oxycarbonyl]-6-oxidanylidene-6-[(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)oxy]hexanoic acid

Systemtic Name: 3-methoxycarbonyl-2,2,3,4,5,5-hexamethyl-4-[(2-methylpropan-2-yl)oxycarbonyl]-6-oxidanylidene-6-[(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)oxy]hexanoic acid Openeye Name: 4-tert-butoxycarbonyl-3-methoxycarbonyl-2,2,3,4,5,5-hexamethyl-6-oxo-6-(1,7,7-trimethylnorbornan-2-yl)oxy-hexanoic acid CAS Name: 3-methoxycarbonyl-2,2,3,4,5,5-hexamethyl-4-[(2-methylpropan-2-yl)oxy-oxomethyl]-6-oxo-6-[(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)oxy]hexanoic acid IUPAC Name: 3-methoxycarbonyl-2,2,3,4,5,5-hexamethyl-4-[(2-methylpropan-2-yl)oxycarbonyl]-6-oxo-6-[(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)oxy]hexanoic acid Traditional Name: 6-(2-bornyloxy)-4-tert-butoxycarbonyl-3-carbomethoxy-6-keto-2,2,3,4,5,5-hexamethyl-hexanoic acid Formula: C29H48O8 MolecularWeight: 524.68662

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(C2)OC(=O)C(C)(C)C(C)(C(=O)OC(C)(C)C)C(C)(C(=O)OC)C(C)(C)C(=O)O)C)C

Isomeric SMILES

CC1(C2CCC1(C(C2)OC(=O)C(C)(C)C(C)(C(=O)OC(C)(C)C)C(C)(C(=O)OC)C(C)(C)C(=O)O)C)C

InChI

InChI=1S/C29H48O8/c1-23(2,3)37-22(34)29(12,28(11,21(33)35-13)25(6,7)19(30)31)26(8,9)20(32)36-18-16-17-14-15-27(18,10)24(17,4)5/h17-18H,14-16H2,1-13H3,(H,30,31)