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ChEBI
> Main
CHEBI:142701 - PC(20:0/18:2(9Z,12Z))
Main
ChEBI Ontology
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ChEBI Name
PC(20:0/18:2(9Z,12Z))
ChEBI ID
CHEBI:142701
Definition
A phosphatidylcholine 38:2 which carries an icosanoyl group at position 1 and a (6
Z
,9
Z
)-18-oxooctadeca-6,9-dien-18-yl group at position 2.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
janelomax
Supplier Information
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Formula
C46H88NO8P
Net Charge
0
Average Mass
814.168
Monoisotopic Mass
813.62476
InChI
InChI=1S/C46H88NO8P/c1-
6-
8-
10-
12-
14-
16-
18-
20-
22-
23-
25-
26-
28-
30-
32-
34-
36-
38-
45(48)
52-
42-
44(43-
54-
56(50,51)
53-
41-
40-
47(3,4)
5)
55-
46(49)
39-
37-
35-
33-
31-
29-
27-
24-
21-
19-
17-
15-
13-
11-
9-
7-
2/h15,17,21,24,44H,6-
14,16,18-
20,22-
23,25-
43H2,1-
5H3/b17-
15-
,24-
21-
/t44-
/m1/s1
InChIKey
KXXLFCAPKGRXBT-FMJYHZMHSA-N
SMILES
C([C@@H](COC(CCCCCCCCCCCCCCCCCCC)=O)OC(CCCCCCC/C=C\C/C=C\CCCCC)=O)OP(OCC[N+](C)(C)C)(=O)[O-]
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via
phosphatidylcholine 38:2
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
PC(20:0/18:2(9Z,12Z)) (
CHEBI:142701
)
is a
phosphatidylcholine 38:2 (
CHEBI:66859
)
IUPAC Name
(2
R
)-
3-
(icosanoyloxy)-
2-
[(9
Z
,12
Z
)-
octadeca-
9,12-
dienoyloxy]propyl 2-
(trimethylammonio)ethyl phosphate
Synonyms
Sources
1-eicosanoyl-2-(9
Z
,12
Z
-octadecadienoyl)-
sn
-glycero-3-phosphocholine
MetaCyc
1-icosanoyl-2-(9
Z
,12
Z
-octadecadienoyl)-
sn
-glycero-3-phosphocholine
ChEBI
PC(20:0/18:2(9
Z
,12
Z
))
SUBMITTER
phosphatidylcholine(20:0/18:2(9
Z
,12
Z
))
ChEBI
Manual Xrefs
Databases
CPD-8371
MetaCyc
HMDB0008270
HMDB
LMGP01011296
LIPID MAPS
View more database links
Last Modified
04 December 2018