Description
Methyl 7α,15-dihydroxydehydroabietate is extracted from the barks of Pinus yunnanensis.
Synonyms
Methyl 7,15-dihydroxydehydroabietate; methyl (1R,4aS,9R,10aR)-9-hydroxy-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
Molecular Formula
C21H30O4
Canonical SMILES
CC12CCCC(C1CC(C3=C2C=CC(=C3)C(C)(C)O)O)(C)C(=O)OC
InChI
InChI=1S/C21H30O4/c1-19(2,24)13-7-8-15-14(11-13)16(22)12-17-20(15,3)9-6-10-21(17,4)18(23)25-5/h7-8,11,16-17,22,24H,6,9-10,12H2,1-5H3/t16-,17-,20-,21-/m1/s1
InChIKey
MRTXWRPVFGYIEY-DEPWHIHDSA-N
Boiling Point
468.9±45.0 °C(Predicted)
Density
1.140±0.06 g/cm3(Predicted)
pKa
14.31±0.60(Predicted)