PENTAN-1-OIC-ACID

Structure

2D structure of PENTAN-1-OIC-ACID
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 7991

Names and identifiers

Name

PENTAN-1-OIC-ACID

Also reported as

VALERIANIC-ACID

IUPAC name

pentanoic acid

SMILES

CCCCC(=O)O

General information

Molecular formula

C5H10O2

Molecular weight

102.13 g/mol

Monoisotopic mass

102.0681 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Rubus idaeus L. subsp. idaeus fruit -
List, P.H. and Horhammer, L., Hager's Handbuch der Pharmazeutischen Praxis, Vols. 2-6, Springer-Verlag, Berlin, 1969-1979.
Sambucus nigra L. fruit -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Vaccinium myrtillus L. fruit -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.