Hyptadienic acid

For Research Use Only.
Category
Terpenes
Cat.No.
NP6730
CAS
128397-09-1
Product Name
Hyptadienic acid
Structure

Product Details

Description
Hyptadienic acid isolated from the plant extract exhibited moderate cytotoxicity against HepG2 cells. Hyptadienic acid is the active principles responsible for the cytotoxicity against three cultured human tumor cell lines, HL-60 (leukemia carcinoma), MCF-7 (breast carcinoma), and Hep-G2 (hepatic carcinoma), with half maximal inhibitory concentration (IC50) values of 12-48 μM.
Synonyms
Hyptadienic acid; 128397-09-1; (3aS,5aR,5bS,7aS,10R,11R,11aS,13aS,13bS)-11-hydroxy-1-(hydroxymethyl)-3,3,5a,5b,10,11,13b-heptamethyl-4,5,6,7,8,9,10,11a,13,13a-decahydro-3aH-cyclopenta[a]chrysene-7a-carboxylic acidHypadienic acidhyptasienic acid
IUPAC Name
(3aS,5aR,5bS,7aS,10R,11R,11aS,13aS,13bS)-11-hydroxy-1-(hydroxymethyl)-3,3,5a,5b,10,11,13b-heptamethyl-4,5,6,7,8,9,10,11a,13,13a-decahydro-3aH-cyclopenta[a]chrysene-7a-carboxylic acid
Molecular Weight
470.7
Molecular Formula
C30H46O4
Canonical SMILES
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(C(=CC5(C)C)CO)C)C)C2C1(C)O)C)C(=O)O
InChI
InChI=1S/C30H46O4/c1-18-10-13-30(24(32)33)15-14-26(4)20(23(30)29(18,7)34)8-9-22-27(26,5)12-11-21-25(2,3)16-19(17-31)28(21,22)6/h8,16,18,21-23,31,34H,9-15,17H2,1-7H3,(H,32,33)/t18-,21+,22+,23-,26-,27-,28+,29-,30+/m1/s1
InChIKey
YFLYOZWZPSYMPX-DCLYBNOZSA-N
Purity
>98%
Appearance
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Application
Anti-inflammatory/antitumor
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