3-Oxotirucalla-7,24-dien-21-oic acid

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For Research Use Only.

Category

Terpenes

Cat.No.

NP6590

CAS

82464-35-5

Product Name

3-Oxotirucalla-7,24-dien-21-oic acid

Structure

Product Details

Description

3-Oxotirucalla-7,24-dien-21-oic acid is a natural compound isolated from the leaves of Rubus alceaefolius.

Synonyms

Lanosta-7,24-dien-21-oic acid, 3-oxo-, (13alpha,14beta,17alpha,20S)-

IUPAC Name

(2S)-6-methyl-2-[(5R,9R,10R,13S,14S,17S)-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]hept-5-enoic acid

Molecular Weight

454.695

Molecular Formula

C30H46O3

Canonical SMILES

CC(=CCCC(C1CCC2(C1(CCC3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C)C(=O)O)C

InChI

InChI=1S/C30H46O3/c1-19(2)9-8-10-20(26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h9,11,20-22,24H,8,10,12-18H2,1-7H3,(H,32,33)/t20-,21-,22-,24-,28+,29-,30+/m0/s1

InChIKey

PYHNHGARAGBCRY-ZYHXIRFQSA-N

Purity

98.0%

Appearance

Powder

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