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174232-42-9

174232-42-9 Structure

174232-42-9 Structure
IdentificationBack Directory
[Name]

Androst-11-ene-14-carboxylic acid,3-(acetyloxy)-4,4,8,12,16-pentamethyl- 15,17,19-trioxo-,methyl ester,(3a,5a,8R,9a,10R,13R)-
[CAS]

174232-42-9
[Synonyms]

Andrastin A, Aspergillus fumigatus
Androst-11-ene-14-carboxylic acid,3-(acetyloxy)-4,4,8,12,16-pentamethyl- 15,17,19-trioxo-,methyl ester,(3a,5a,8R,9a,10R,13R)-
Androst-11-ene-14-carboxylic acid, 3-(acetyloxy)-4,4,8,12,16-pentamethyl-15,17,19-trioxo-, methyl ester, (3β,5β,8α,9β,10α,13α)-
[Molecular Formula]

C28H38O7
[MOL File]

174232-42-9.mol
[Molecular Weight]

486.6
Chemical PropertiesBack Directory
[Boiling point ]

560.3±50.0 °C(Predicted)
[density ]

1.19±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMF: Soluble; DMSO: Soluble; Ethanol: Soluble; Methanol: Soluble
[form ]

A crystalline solid
[pka]

8.84±0.70(Predicted)
[color ]

Off-white
[InChIKey]

GRBXNADBNJGZRK-BCMOVVIDSA-N
[SMILES]

O(C1C(C2[C@@]([C@@H]3C(C4([C@](C(=C3)C)(C(=O)C(C4=O)C)C)C(=O)OC)(CC2)C)(CC1)C=O)(C)C)C(=O)C
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

Andrastin A is a mycotoxin, PFTase inhibitor, and anticancer compound.
[Biological Activity]

Andrastin A is a meroterpenoid protein farnesyltransferase inhibitor with anticancer activity. It has been shown to inhibit the farnesyltransferase activity of the oncogenic Ras proteins and inhibit the efflux of anticancer drugs from multidrug-resistant cancer cells.''Farnesyltransferase inhibitor with anticancer activity; mycotoxin
[storage]

+4°C
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