2-Oxopomolic acid

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For Research Use Only.

Category

Terpenes

Cat.No.

NP6510

CAS

54963-52-9

Product Name

2-Oxopomolic acid

Structure

Product Details

Description

2-Oxopomolic Acid is a natural compound that has garnered significant attention within the research of biomedical research due to its remarkable anti-inflammatory and anticancer properties. This natural compound is admired for its extraordinary capabilities exhibiting an unprecedented ability to hinder the production of pro-inflammatory cytokines.

Synonyms

Urs-12-en-28-oic acid, 3,19-dihydroxy-2-oxo-, (3β)-

IUPAC Name

(1R,2R,4aS,6aR,6aS,6bR,8aR,10R,12aR,14bS)-1,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-11-oxo-3,4,5,6,6a,7,8,8a,10,12,13,14b-dodecahydro-2H-picene-4a-carboxylic acid

Molecular Weight

486.68

Molecular Formula

C30H46O5

Canonical SMILES

CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(=O)C(C5(C)C)O)C)C)C2C1(C)O)C)C(=O)O

InChI

InChI=1S/C30H46O5/c1-17-10-13-30(24(33)34)15-14-27(5)18(22(30)29(17,7)35)8-9-21-26(4)16-19(31)23(32)25(2,3)20(26)11-12-28(21,27)6/h8,17,20-23,32,35H,9-16H2,1-7H3,(H,33,34)/t17-,20+,21-,22-,23+,26+,27-,28-,29-,30+/m1/s1

InChIKey

HQZKQSIAHGHXDL-SGOBLLPSSA-N

Boiling Point

616.9±55.0 °C(Predicted)

Density

1.18±0.1 g/cm3(Predicted)

pKa

4.47±0.70(Predicted)

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