Homobaldrinal

Names

[ Name ]:
Homobaldrinal

[Synonym ]:
(7-Formylcyclopenta[c]pyran-4-yl)methyl 3-methylbutanoate
Butanoic acid, 3-methyl-, (7-formylcyclopenta[c]pyran-4-yl)methyl ester
BUTANOIC ACID,3-METHYL-,(7-FORMYLCYCLOPENTA(c)PYRAN-4-YL)METHYL ESTER
Homobaldrinal
I07-0300

Biological Activity

[Description]:

Homobaldrinal is a decomposition product of Valepotriate (HY-N0718). Homobaldrinal exhibits genotoxic activity in the Salmonella/microsome test[1].

[Related Catalog]:

Research Areas >> Cancer

Signaling Pathways >> Others >> Others

Research Areas >> Neurological Disease

[References]

[1]. W von der Hude, et al.Bacterial Mutagenicity of the Tranquilizing Constituents of Valerianaceae Roots. Mutat Res

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
462.1±30.0 °C at 760 mmHg

[ Molecular Formula ]:
C₁₅H₁₆O₄

[ Molecular Weight ]:
260.285

[ Flash Point ]:
207.4±24.6 °C

[ Exact Mass ]:
260.104858

[ PSA ]:
56.51000

[ LogP ]:
0.44

[ Vapour Pressure ]:
0.0±1.1 mmHg at 25°C

[ Index of Refraction ]:
1.555

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: EK7906000

CHEMICAL NAME :: Butanoic acid, 3-methyl-, (7-formylcyclopenta(c)pyran-4-yl)methyl ester

CAS REGISTRY NUMBER :: 67910-07-0

LAST UPDATED :: 199410

DATA ITEMS CITED :: 3

MOLECULAR FORMULA :: C15-H16-O4

MOLECULAR WEIGHT :: 260.31

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :: DNA repair

TEST SYSTEM :: Bacteria - Escherichia coli

DOSE/DURATION :: 100 nmol/L

REFERENCE :: MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 169,23,1986