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Catalog | BBC95416254 |
CAS | 95416-25-4 |
Synonyms | 15-Hydroxy-7-oxodehydroabieticacid |
IUPAC Name | (1R,4aS,10aR)-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-9-oxo-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid |
Molecular Weight | 330.42 |
Molecular Formula | C20H26O4 |
Canonical SMILES | C[C@]12CCC[C@@]([C@@H]1CC(=O)C3=C2C=CC(=C3)C(C)(C)O)(C)C(=O)O |
InChI | InChI=1S/C20H26O4/c1-18(2,24)12-6-7-14-13(10-12)15(21)11-16-19(14,3)8-5-9-20(16,4)17(22)23/h6-7,10,16,24H,5,8-9,11H2,1-4H3,(H,22,23)/t16-,19-,20-/m1/s1 |
InChI Key | MXPXAZNVQUWDFH-NSISKUIASA-N |
Purity | 98% |
Appearance | Solid |
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