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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:89852 - PC(o-20:0/18:3(9Z,12Z,15Z))
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ChEBI Ontology
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ChEBI Name
PC(o-20:0/18:3(9Z,12Z,15Z))
ChEBI ID
CHEBI:89852
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C46H88NO7P
Net Charge
0
Average Mass
798.169
Monoisotopic Mass
797.62984
InChI
InChI=1S/C46H88NO7P/c1-
6-
8-
10-
12-
14-
16-
18-
20-
22-
23-
24-
26-
28-
30-
32-
34-
36-
38-
41-
51-
43-
45(44-
53-
55(49,50)
52-
42-
40-
47(3,4)
5)
54-
46(48)
39-
37-
35-
33-
31-
29-
27-
25-
21-
19-
17-
15-
13-
11-
9-
7-
2/h9,11,15,17,21,25,45H,6-
8,10,12-
14,16,18-
20,22-
24,26-
44H2,1-
5H3/b11-
9-
,17-
15-
,25-
21-
/t45-
/m1/s1
InChIKey
APWUUZRAVVATRC-GBRUYZQDSA-N
SMILES
O(C[C@](COP([O-])(=O)OCC[N+](C)(C)C)(OC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O)[H])CCCCCCCCCCCCCCCCCCCC
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
Found in saliva
(UBERON:0001836)
. See: Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation)
Homo sapiens
(NCBI:txid9606)
Found in urine
(BTO:0001419)
. See:
PubMed
ChEBI Ontology
Outgoing
PC(o-20:0/18:3(9Z,12Z,15Z)) (
CHEBI:89852
)
is a
1-(1,2-saturated-acyl)-2-acyl-
sn
-glycerolipid (
CHEBI:167498
)
PC(o-20:0/18:3(9Z,12Z,15Z)) (
CHEBI:89852
)
is a
glycerophosphocholine (
CHEBI:36313
)
Synonyms
Sources
(2-
{[(2R)-
3-
(icosyloxy)-
2-
[(9Z,12Z,15Z)-
octadeca-
9,12,15-
trienoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium
HMDB
1-Arachidyl-2-a-linolenoyl-sn-glycero-3-phosphocholine
HMDB
1-Arachidyl-2-alpha-linolenoyl-sn-glycero-3-phosphocholine
HMDB
GPCho(20:0/18:3)
HMDB
GPCho(20:0/18:3n3)
HMDB
GPCho(20:0/18:3w3)
HMDB
GPCho(38:3)
HMDB
Lecithin
HMDB
PC ae C38:3
HMDB
PC(20:0/18:3)
HMDB
PC(20:0/18:3n3)
HMDB
PC(20:0/18:3w3)
HMDB
PC(38:3)
HMDB
PC(O-38:3)
HMDB
Phosphatidylcholine(20:0/18:3)
HMDB
Phosphatidylcholine(20:0/18:3n3)
HMDB
Phosphatidylcholine(20:0/18:3w3)
HMDB
Phosphatidylcholine(38:3)
HMDB
Manual Xref
Database
HMDB0013440
HMDB
View more database links
Citation
Type
Source
24023812
PubMed citation
Europe PMC