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ChEBI
> Main
CHEBI:78228 - 1,2-dioctanoyl-
sn
-glycero-3-phosphocholine
Main
ChEBI Ontology
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ChEBI Name
1,2-dioctanoyl-
sn
-glycero-3-phosphocholine
ChEBI ID
CHEBI:78228
ChEBI ASCII Name
1,2-dioctanoyl-sn-glycero-3-phosphocholine
Definition
A 1,2-diacyl-
sn
-glycero-3-phosphocholine in which the acyl groups at positions 1 and 2 are specified as octanoyl.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Lucila Aimo
Secondary ChEBI IDs
CHEBI:44735
Supplier Information
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Molfile
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Molfile
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Formula
C24H48NO8P
Net Charge
0
Average Mass
509.61360
Monoisotopic Mass
509.31175
InChI
InChI=1S/C24H48NO8P/c1-
6-
8-
10-
12-
14-
16-
23(26)
30-
20-
22(33-
24(27)
17-
15-
13-
11-
9-
7-
2)
21-
32-
34(28,29)
31-
19-
18-
25(3,4)
5/h22H,6-
21H2,1-
5H3/t22-
/m1/s1
InChIKey
YHIXRNNWDBPKPW-JOCHJYFZSA-N
SMILES
CCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCC
ChEBI Ontology
Outgoing
1,2-dioctanoyl-
sn
-glycero-3-phosphocholine (
CHEBI:78228
)
is a
1,2-diacyl-
sn
-glycero-3-phosphocholine (
CHEBI:57643
)
1,2-dioctanoyl-
sn
-glycero-3-phosphocholine (
CHEBI:78228
)
is a
octanoate ester (
CHEBI:87657
)
IUPAC Name
(2
R
)-2,3-bis(octanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms
Sources
1,2-dicapryloyl-
sn
-glycero-3-phosphocholine
ChEBI
1,2-dioctanoyl-
sn
-glycero-3-phosphocholine
UniProt
1,2-Octanoylphosphatidylcholine
ChemIDplus
dicapryloyl-
L
-α-lecithin
LIPID MAPS
dioctanoyl-
L
-α-glycerophosphorylcholine
LIPID MAPS
dioctanoyl-
L
-α-phosphatidylcholine
LIPID MAPS
PC 8:0/8:0
SUBMITTER
PC(8:0/8:0)
LIPID MAPS
Manual Xrefs
Databases
LMGP01011251
LIPID MAPS
PC8
PDBeChem
View more database links
Registry Numbers
Types
Sources
3739975
Reaxys Registry Number
Reaxys
41017-85-0
CAS Registry Number
ChemIDplus
Last Modified
27 August 2015