Quillaic acid

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For Research Use Only.

Category

Triterpenoids

Cat.No.

NP7037

CAS

631-01-6

Product Name

Quillaic acid

Structure

Product Details

Description

Quillaic acid is the major aglycone of the widely studied saponins of the Chilean indigenous tree Quillaja saponaria Mol and can elicit dose-dependent antinociceptive effects in two murine thermal models.

Synonyms

Quillaja sapogenin

IUPAC Name

(4aR,5R,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-formyl-5,10-dihydroxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

Molecular Weight

486.68

Molecular Formula

C30H46O5

Canonical SMILES

CC1(CCC2(C(C1)C3=CCC4C5(CCC(C(C5CCC4(C3(CC2O)C)C)(C)C=O)O)C)C(=O)O)C

InChI

InChI=1S/C30H46O5/c1-25(2)13-14-30(24(34)35)19(15-25)18-7-8-21-26(3)11-10-22(32)27(4,17-31)20(26)9-12-28(21,5)29(18,6)16-23(30)33/h7,17,19-23,32-33H,8-16H2,1-6H3,(H,34,35)/t19-,20+,21+,22-,23+,26-,27-,28+,29+,30+/m0/s1

InChIKey

MQUFAARYGOUYEV-UAWZMHPWSA-N

Purity

>98%

Density

1.2±0.1 g/cm3

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