ISOPIMARIC ACID
(1R,4aR)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
Also Known As: ISOPIMARIC ACID, (1R,4aR)-1,4a,7-trimethyl-7-vinyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid, (1R,4aR)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid, 1-Phenanthrenecarboxylic acid, 7-ethenyl-1,2,3,4,4a,4b,5, 6,7,8,10,10a-dodecahydro-1,4a,7-trimethyl-, [1R-(1?,4ass,4b? ,7?,10a?)]-
| Molecular Formula | C20H30O2 |
|---|---|
| Molecular Weight | 302.22458 g/mol |
| LogP | 5.21 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 302.22458 |
| Heavy Atoms | 22 |
| Complexity | 533 |
Chemical Identifiers
| CAS Number | 5835-26-7 |
|---|---|
| SMILES | C[C@]12CCC[C@@](C1CC=C3C2CCC(C3)(C)C=C)(C)C(=O)O |
Product Overview
ISOPIMARIC ACID (CAS 5835-26-7), with molecular formula C20H30O2 and molecular weight 302.22458 g/mol. IUPAC: (1R,4aR)-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid.
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