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ChEBI
> Main
CHEBI:132478 - sphinganine-1-phosphocholine
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ChEBI Name
sphinganine-1-phosphocholine
ChEBI ID
CHEBI:132478
Definition
A phosphosphingolipid consisting of sphinganine having a phosphocholine group attached to its primary hydroxyl group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Molfile
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Molfile
Formula
C23H51N2O5P
Net Charge
0
Average Mass
466.636
Monoisotopic Mass
466.35356
InChI
InChI=1S/C23H51N2O5P/c1-
5-
6-
7-
8-
9-
10-
11-
12-
13-
14-
15-
16-
17-
18-
23(26)
22(24)
21-
30-
31(27,28)
29-
20-
19-
25(2,3)
4/h22-
23,26H,5-
21,24H2,1-
4H3/t22-
,23+/m0/s1
InChIKey
GSEOJHIBPQRSNH-XZOQPEGZSA-N
SMILES
O=P(OCC[N+](C)(C)C)(OC[C@H](N)[C@@H](CCCCCCCCCCCCCCC)O)[O-]
Metabolite of Species
Details
Calanus helgolandicus
(NCBI:txid114068)
See:
MetaboLights Study
Calanus helgolandicus
(NCBI:txid114068)
See:
PubMed
Roles Classification
Biological Role
(s):
marine metabolite
Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
sphinganine-1-phosphocholine (
CHEBI:132478
)
has functional parent
sphinganine (
CHEBI:16566
)
sphinganine-1-phosphocholine (
CHEBI:132478
)
has role
marine metabolite (
CHEBI:76507
)
sphinganine-1-phosphocholine (
CHEBI:132478
)
is a
ammonium betaine (
CHEBI:35284
)
sphinganine-1-phosphocholine (
CHEBI:132478
)
is a
phosphocholines (
CHEBI:36700
)
sphinganine-1-phosphocholine (
CHEBI:132478
)
is a
phosphosphingolipid (
CHEBI:35786
)
IUPAC Name
(2
S
,3
R
)-2-amino-3-hydroxyoctadecyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms
Sources
dihydrosphingosine-1-phosphocholine
ChEBI
dihydrosphingosylphosphorylcholine
ChEBI
LysoSM(d18:0)
ChEBI
SM(d18:0/0:0)
LIPID MAPS
Manual Xref
Database
LMSP01060002
LIPID MAPS
View more database links
Registry Number
Type
Source
9819448
Reaxys Registry Number
Reaxys
Citation
Type
Source
26364855
PubMed citation
Europe PMC
Last Modified
13 January 2017