Macedonic acid

For Research Use Only.
Category
Triterpenoids
Cat.No.
NP7243
CAS
39022-00-9
Product Name
Macedonic acid
Structure

Product Details

Description
Macedonic acid is a natural product found in Glycyrrhiza yunnanensis.
Synonyms
3,19-Dihydroxy-oleana-11,13(18)dien-28-oic acid
IUPAC Name
(2S,3R,4aS,6aR,6aS,6bR,8aR,10S,12aS)-3,10-dihydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12-dodecahydropicene-2-carboxylic acid
Molecular Weight
470.68
Molecular Formula
C30H46O4
Canonical SMILES
CC1(C2CCC3(C(C2(CCC1O)C)C=CC4=C5CC(C(CC5(CCC43C)C)O)(C)C(=O)O)C)C
InChI
InChI=1S/C30H46O4/c1-25(2)20-10-13-30(7)21(27(20,4)12-11-22(25)31)9-8-18-19-16-28(5,24(33)34)23(32)17-26(19,3)14-15-29(18,30)6/h8-9,20-23,31-32H,10-17H2,1-7H3,(H,33,34)/t20-,21+,22-,23+,26-,27-,28-,29+,30+/m0/s1
InChIKey
QWQDOXKORDLUFG-JKBYBQJKSA-N
Purity
98%
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