Catalog |
BBC57475624 |
CAS |
57475-62-4 |
Structure |  |
Synonyms |
(3beta,4alpha)-13,28-Epoxyolean-11-ene-3,23-diol |
IUPAC Name |
(1S,4S,5R,8R,9R,10S,13S,14R,17S,18R)-9-(hydroxymethyl)-4,5,9,13,20,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracos-15-en-10-ol |
Molecular Weight |
456.7 |
Molecular Formula |
C30H48O3 |
Canonical SMILES |
C[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2C=C[C@@]45[C@]3(CC[C@@]6([C@H]4CC(CC6)(C)C)CO5)C)C)(C)CO)O |
InChI |
InChI=1S/C30H48O3/c1-24(2)13-15-29-16-14-28(6)27(5)11-7-20-25(3,10-9-23(32)26(20,4)18-31)21(27)8-12-30(28,33-19-29)22(29)17-24/h8,12,20-23,31-32H,7,9-11,13-19H2,1-6H3/t20-,21-,22-,23+,25+,26+,27-,28+,29-,30+/m1/s1 |
InChI Key |
AXHYCHLBHJUCPN-TYFPGHAOSA-N |
Boiling Point |
552.0±50.0 °C |
Purity |
98% |
Density |
1.12±0.1 g/ml |
Appearance |
Solid |
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