Olean-12-ene-3,11-dione

For Research Use Only.
Category
Terpenes
Cat.No.
NP6320
CAS
2935-32-2
Product Name
Olean-12-ene-3,11-dione
Structure

Product Details

Description
Olean-12-ene-3,11-dione is a natural triterpenoid found in the herbs of Euonymus hederaceus Champ. ex Benth.
Synonyms
3,11-Dioxo-β-amyrene; 5α-Oleana-12-ene-3,11-dione; 18Beta(H)-olean-12-ene-3,11-dione
IUPAC Name
(4aR,6aR,6bS,8aR,12aR,14aR,14bS)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,4a,5,6,7,8,9,10,12,12a,14a-dodecahydropicene-3,14-dione
Molecular Weight
438.7
Molecular Formula
C30H46O2
Canonical SMILES
CC1(CCC2(CCC3(C(=CC(=O)C4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1)C)C)C
InChI
InChI=1S/C30H46O2/c1-25(2)13-14-27(5)15-16-29(7)19(20(27)18-25)17-21(31)24-28(6)11-10-23(32)26(3,4)22(28)9-12-30(24,29)8/h17,20,22,24H,9-16,18H2,1-8H3/t20-,22-,24+,27+,28-,29+,30+/m0/s1
InChIKey
XQIVDOSRZQSWFL-QKMNFNRLSA-N
Boiling Point
521.9±49.0 °C(Predicted)
Melting Point
228-231 °C
Purity
>93%
Density
1.05±0.1 g/cm3(Predicted)
Appearance
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