Description
Erythrodiol isolated from the herbs of Callicarpa bodinieri Levl. It may have therapeutic potential as new vasodilator drugs.
Synonyms
12-OLEANENE-3,28-DIOL
IUPAC Name
(3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-ol
Molecular Formula
C30H50O2
Canonical SMILES
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)CO)C
InChI
InChI=1S/C30H50O2/c1-25(2)14-16-30(19-31)17-15-28(6)20(21(30)18-25)8-9-23-27(5)12-11-24(32)26(3,4)22(27)10-13-29(23,28)7/h8,21-24,31-32H,9-19H2,1-7H3/t21-,22-,23+,24-,27-,28+,29+,30+/m0/s1
InChIKey
PSZDOEIIIJFCFE-OSQDELBUSA-N
Boiling Point
520.5±50.0 °C(Predicted)
Melting Point
230-231°C(lit.)
Solubility
Chloroform (Slightly, Sonicated), methanol (Slightly)
Application
antiproliferative and proapoptotic activities
Storage
-20°C Freezer, Under inert atmosphere
pKa
15.09±0.10(Predicted)
Uses
It is an essential reagent in the synthesis of aminopropoxytriterpenoids that have anticancer activity. 3β-Erythrodiol has pharmacological property as a vasodilatory agent. It may have interesting therapeutic potential as a new vasodilator drug, for protecting the cardiovascular system.