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> Main
CHEBI:70850 - isoheptadecanoic acid
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ChEBI Name
isoheptadecanoic acid
ChEBI ID
CHEBI:70850
Definition
A branched-chain saturated fatty acid comprising hexadecanoic (palmitic) acid substituted at position 15 by a methyl group.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C17H34O2
Net Charge
0
Average Mass
270.45070
Monoisotopic Mass
270.25588
InChI
InChI=1S/C17H34O2/c1-16(2)14-12-10-8-6-4-3-5-7-9-11-13-15-17(18)19/h16H,3-15H2,1-2H3,(H,18,19)
InChIKey
IIUXHTGBZYEGHI-UHFFFAOYSA-N
SMILES
CC(C)CCCCCCCCCCCCCC(O)=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
isoheptadecanoic acid (
CHEBI:70850
)
is a
branched-chain saturated fatty acid (
CHEBI:39417
)
isoheptadecanoic acid (
CHEBI:70850
)
is a
long-chain fatty acid (
CHEBI:15904
)
isoheptadecanoic acid (
CHEBI:70850
)
is a
methyl-branched fatty acid (
CHEBI:62499
)
isoheptadecanoic acid (
CHEBI:70850
)
is conjugate acid of
isoheptadecanoate (
CHEBI:70838
)
Incoming
ω-hydroxy-15-methylpalmitic acid (
CHEBI:84939
)
has functional parent
isoheptadecanoic acid (
CHEBI:70850
)
isoheptadecanoyl-CoA (
CHEBI:71540
)
has functional parent
isoheptadecanoic acid (
CHEBI:70850
)
isoheptadecanoate (
CHEBI:70838
)
is conjugate base of
isoheptadecanoic acid (
CHEBI:70850
)
IUPAC Name
15-methylhexadecanoic acid
Synonyms
Sources
15-methyl hexadecanoic acid
ChemIDplus
15-methyl palmitic acid
LIPID MAPS
15-methylpalmitic acid
ChEBI
C17:0 (iso)
ChEBI
i-17:0
ChEBI
i-C17:0
ChEBI
i17:0
ChEBI
iso-C17:0
ChEBI
iso-margaric acid
ChEBI
isomargaric acid
ChEBI
Manual Xrefs
Databases
EP2143705
Patent
LMFA01020012
LIPID MAPS
US2008214666
Patent
US7109364
Patent
View more database links
Registry Numbers
Types
Sources
1603-03-8
CAS Registry Number
ChemIDplus
1781002
Reaxys Registry Number
Reaxys
Citations
Types
Sources
15340492
PubMed citation
Europe PMC
18676815
PubMed citation
Europe PMC
Last Modified
26 March 2015