CHEBI:180248 - 3-methyl-2-nonenoic acid

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ChEBI Name 3-methyl-2-nonenoic acid
ChEBI ID CHEBI:180248
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C10H18O2
Net Charge 0
Average Mass 170.252
Monoisotopic Mass 170.13068
InChI InChI=1S/C10H18O2/c1-3-4-5-6-7-9(2)8-10(11)12/h8H,3-7H2,1-2H3,(H,11,12)/b9-8+
InChIKey UOOWECZOWUNYLA-CMDGGOBGSA-N
SMILES OC(=O)\C=C(\CCCCCC)/C
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 3-methyl-2-nonenoic acid (CHEBI:180248) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name
(E)-3-methylnon-2-enoic acid
Manual Xrefs Databases
4445794 ChemSpider
LMFA01020128 LIPID MAPS
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Registry Number Type Source
35205-76-6 CAS Registry Number ChemIDplus