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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:77955 -
L
-
erythro
-
N
-dodecanoylsphingosine
Main
ChEBI Ontology
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ChEBI Name
L
-
erythro
-
N
-dodecanoylsphingosine
ChEBI ID
CHEBI:77955
ChEBI ASCII Name
L-erythro-N-dodecanoylsphingosine
Definition
A sphingolipid that is the
N
-dodecanoyl (lauroyl) derivative of
L
-
erythro
-sphingosine.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Nevila Nouspikel
Supplier Information
ZINC000008552317
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Formula
C30H59NO3
Net Charge
0
Average Mass
481.79440
Monoisotopic Mass
481.44949
InChI
InChI=1S/C30H59NO3/c1-
3-
5-
7-
9-
11-
13-
14-
15-
16-
18-
19-
21-
23-
25-
29(33)
28(27-
32)
31-
30(34)
26-
24-
22-
20-
17-
12-
10-
8-
6-
4-
2/h23,25,28-
29,32-
33H,3-
22,24,26-
27H2,1-
2H3,(H,31,34)
/b25-
23+/t28-
,29+/m1/s1
InChIKey
HXFPPRPLRSPNIB-GYMIWBHYSA-N
SMILES
CCCCCCCCCCCCC\C=C\[C@H](O)[C@@H](CO)NC(=O)CCCCCCCCCCC
ChEBI Ontology
Outgoing
L
-
erythro
-
N
-dodecanoylsphingosine (
CHEBI:77955
)
has functional parent
L
-
erythro
-sphingosine (
CHEBI:46967
)
L
-
erythro
-
N
-dodecanoylsphingosine (
CHEBI:77955
)
has functional parent
dodecanoic acid (
CHEBI:30805
)
L
-
erythro
-
N
-dodecanoylsphingosine (
CHEBI:77955
)
is a
sphingolipid (
CHEBI:26739
)
IUPAC Name
N
-[(2
R
,3
S
,4
E
)-1,3-dihydroxyoctadec-4-en-2-yl]dodecanamide
Synonyms
Sources
L
-erythro-
N
-(dodecanoyl)sphing-4-enine
UniProt
L
-
erythro
-
N
-lauroylsphingosine
ChEBI
N
-dodecanoyl-
L
-
erythro
-sphingosine
ChEBI
N
-lauroyl-
L
-
erythro
-sphingosine
ChEBI
Registry Number
Type
Source
10777443
Reaxys Registry Number
Reaxys
Citation
Type
Source
12783875
PubMed citation
SUBMITTER
Last Modified
02 October 2014