3,4-Secocucurbita-4,24-diene-3,26,29-trioic acid

Modify Date: 2025-08-20 14:13:04

3,4-Secocucurbita-4,24-diene-3,26,29-trioic acid Structure
3,4-Secocucurbita-4,24-diene-3,26,29-trioic acid structure
Common Name 3,4-Secocucurbita-4,24-diene-3,26,29-trioic acid
CAS Number 329975-47-5 Molecular Weight 516.71
Density 1.1±0.1 g/cm3 Boiling Point 669.2±20.0 °C at 760 mmHg
Molecular Formula C31H48O6 Melting Point N/A
MSDS N/A Flash Point 372.5±18.3 °C

 Use of 3,4-Secocucurbita-4,24-diene-3,26,29-trioic acid


(24E)-3,4-Secocucurbita-4,24-diene-3,26,29-trioic acid is a potent PTP1B inhibitor, with an IC50 of 0.4 μM. (24E)-3,4-Secocucurbita-4,24-diene-3,26,29-trioic acid exhibits potent PTP1B inhibitory activity without cytotoxicity[1].

 Names

Name (2E,6R)-6-[(3R,3aR,5aS,7Z,9aR,9bS)-6-(2-Carboxyethyl)-7-(1-carbox yethylidene)-3a,5a,9b-trimethyldodecahydro-1H-cyclopenta[a]naphth alen-3-yl]-2-methyl-2-heptenoic acid
Synonym More Synonyms

  Biological Activity

Description (24E)-3,4-Secocucurbita-4,24-diene-3,26,29-trioic acid is a potent PTP1B inhibitor, with an IC50 of 0.4 μM. (24E)-3,4-Secocucurbita-4,24-diene-3,26,29-trioic acid exhibits potent PTP1B inhibitory activity without cytotoxicity[1].
Related Catalog
Target

IC50: 0.4 μM (PTP1B)[1]

References

[1]. Maarisit W, et al. Protein tyrosine phosphatase 1B inhibitory properties of seco-cucurbitane triterpenes obtained from fruiting bodies of Russula lepida. J Nat Med. 2017 Jan;71(1):334-337.  

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 669.2±20.0 °C at 760 mmHg
Molecular Formula C31H48O6
Molecular Weight 516.71
Flash Point 372.5±18.3 °C
Exact Mass 502.329437
PSA 111.90000
LogP 8.45
Vapour Pressure 0.0±4.4 mmHg at 25°C
Index of Refraction 1.537
InChIKey MLKGNOBMWJPGDM-HKQAYJIZSA-N
SMILES CC(=CCCC(C)C1CCC2(C)C3CCC(=C(C)C(=O)O)C(CCC(=O)O)C3(C)CCC12C)C(=O)O

 Safety Information

Hazard Codes Xi

 Synonyms

1H-Benz[e]indene-6-propanoic acid, 7-(1-carboxyethylidene)-3-[(1R,4E)-5-carboxy-1-methyl-4-hexen-1-yl]dodecahydro-3a,5a,9b-trimethyl-, (3R,3aR,5aS,7Z,9aR,9bS)-
(2E,6R)-6-[(3R,3aR,5aS,7Z,9aR,9bS)-6-(2-Carboxyethyl)-7-(1-carboxyethylidene)-3a,5a,9b-trimethyldodecahydro-1H-cyclopenta[a]naphthalen-3-yl]-2-methyl-2-heptenoic acid
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