CHEBI:173389 - 2-Methyl-3-pentenoic acid

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ChEBI Name 2-Methyl-3-pentenoic acid
ChEBI ID CHEBI:173389
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C6H10O2
Net Charge 0
Average Mass 114.144
Monoisotopic Mass 114.06808
InChI InChI=1S/C6H10O2/c1-3-4-5(2)6(7)8/h3-5H,1-2H3,(H,7,8)/b4-3+
InChIKey NFRJJFMXYKSRPK-ONEGZZNKSA-N
SMILES OC(=O)C(C)/C=C/C
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-Methyl-3-pentenoic acid (CHEBI:173389) is a methyl-branched fatty acid (CHEBI:62499)
Incoming ethyl 2-methyl-3-pentenoate (CHEBI:180294) has functional parent 2-Methyl-3-pentenoic acid (CHEBI:173389)
IUPAC Name
(E)-2-methylpent-3-enoic acid
Manual Xref Database
4940555 ChemSpider
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Registry Number Type Source
37674-63-8 CAS Registry Number ChemIDplus
Last Modified
14 January 2022