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CHEBI:181258 - (4E,6E)-2-(Hydroxymethyl)-3-(3-methoxy-3-oxopropyl)deca-4,6-dienoic acid

ChEBI IDCHEBI:181258
ChEBI Name(4E,6E)-2-(Hydroxymethyl)-3-(3-methoxy-3-oxopropyl)deca-4,6-dienoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O5
Net Charge0
Average Mass284.352
Monoisotopic Mass284.16237
SMILESCCC/C=C/C=C/C(CCC(=O)OC)C(CO)C(=O)O
InChIInChI=1S/C15H24O5/c1-3-4-5-6-7-8-12(9-10-14(17)20-2)13(11-16)15(18)19/h5-8,12-13,16H,3-4,9-11H2,1-2H3,(H,18,19)/b6-5+,8-7+
InChIKeyPVHUKALHRBPQNM-BSWSSELBSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(4E,6E)-2-(Hydroxymethyl)-3-(3-methoxy-3-oxopropyl)deca-4,6-dienoic acid (CHEBI:181258) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name 
(4E,6E)-2-(hydroxymethyl)-3-(3-methoxy-3-oxopropyl)deca-4,6-dienoic acid
Manual XrefsDatabases
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