CAS | 126778-79-8 |
Structure | |
Synonyms | Sventenic acid |
IUPAC Name | (1R,2S,4S,5S,9S,10S,13R)-2-hydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid |
Molecular Weight | 318.45 |
Molecular Formula | C20H30O3 |
Canonical SMILES | C[C@@]12CCC[C@]([C@H]1C[C@@H]([C@]34[C@H]2CC[C@H](C3)C(=C)C4)O)(C)C(=O)O |
InChI | InChI=1S/C20H30O3/c1-12-10-20-11-13(12)5-6-14(20)18(2)7-4-8-19(3,17(22)23)15(18)9-16(20)21/h13-16,21H,1,4-11H2,2-3H3,(H,22,23)/t13-,14+,15+,16+,18+,19+,20+/m1/s1 |
InChI Key | KMLXVEXJZSTMBV-HNFSSWLOSA-N |
Boiling Point | 467.4±45.0 °C |
Purity | 98% |
Density | 1.16±0.1 g/ml |
pKa | 4.60±0.60 |
Appearance | Solid |
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