CHEBI:55330 - 16-feruloyloxypalmitic acid

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ChEBI Name 16-feruloyloxypalmitic acid
ChEBI ID CHEBI:55330
Definition The O-feruloyl derivative of 16-hydroxyhexadecanoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C26H40O6
Net Charge 0
Average Mass 448.59220
Monoisotopic Mass 448.28249
InChI InChI=1S/C26H40O6/c1-31-24-21-22(16-18-23(24)27)17-19-26(30)32-20-14-12-10-8-6-4-2-3-5-7-9-11-13-15-25(28)29/h16-19,21,27H,2-15,20H2,1H3,(H,28,29)/b19-17+
InChIKey DCZDUZNVOVFUCD-HTXNQAPBSA-N
SMILES COc1cc(\C=C\C(=O)OCCCCCCCCCCCCCCCC(O)=O)ccc1O
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 16-feruloyloxypalmitic acid (CHEBI:55330) has functional parent ferulic acid (CHEBI:17620)
16-feruloyloxypalmitic acid (CHEBI:55330) is a monocarboxylic acid (CHEBI:25384)
16-feruloyloxypalmitic acid (CHEBI:55330) is conjugate acid of 16-feruloyloxypalmitate (CHEBI:55331)
Incoming 16-feruloyloxypalmitate (CHEBI:55331) is conjugate base of 16-feruloyloxypalmitic acid (CHEBI:55330)
IUPAC Name
16-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}hexadecanoic acid
Synonym Source
16-Feruloyloxypalmitic acid KEGG COMPOUND
Manual Xref Database
C18217 KEGG COMPOUND
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Registry Numbers Types Sources
5630504 Beilstein Registry Number Beilstein
6824517 Beilstein Registry Number Beilstein
Last Modified
28 July 2014