CHEBI:165379 - 3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid

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ChEBI Name 3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid
ChEBI ID CHEBI:165379
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H14O5
Net Charge 0
Average Mass 202.206
Monoisotopic Mass 202.08412
InChI InChI=1S/C9H14O5/c1-2-6(5-10)7(3-8(11)12)4-9(13)14/h2,7,10H,3-5H2,1H3,(H,11,12)(H,13,14)/b6-2+
InChIKey FUMUSIMACHNZQF-QHHAFSJGSA-N
SMILES OC\C(\C(CC(O)=O)CC(O)=O)=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 3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid (CHEBI:165379) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name
3-[(Z)-1-hydroxybut-2-en-2-yl]pentanedioic acid
Manual Xrefs Databases
25936984 ChemSpider
HMDB0033092 HMDB
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