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ChEBI
> Main
CHEBI:82842 -
N
-octanoylphytosphingosine
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ChEBI Name
N
-octanoylphytosphingosine
ChEBI ID
CHEBI:82842
ChEBI ASCII Name
N-octanoylphytosphingosine
Definition
A phytoceramide in which the
N
-acyl group is specified as octanoyl.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Lucila Aimo
Supplier Information
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Formula
C26H53NO4
Net Charge
0
Average Mass
443.70330
Monoisotopic Mass
443.39746
InChI
InChI=1S/C26H53NO4/c1-
3-
5-
7-
9-
10-
11-
12-
13-
14-
15-
17-
18-
20-
24(29)
26(31)
23(22-
28)
27-
25(30)
21-
19-
16-
8-
6-
4-
2/h23-
24,26,28-
29,31H,3-
22H2,1-
2H3,(H,27,30)
/t23-
,24+,26-
/m0/s1
InChIKey
XQNJLWJVISBYSS-GSLIJJQTSA-N
SMILES
CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@H](CO)NC(=O)CCCCCCC
Roles Classification
Biological Role
(s):
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
(via
N-acylphytosphingosine
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
N
-octanoylphytosphingosine (
CHEBI:82842
)
has functional parent
octanoic acid (
CHEBI:28837
)
N
-octanoylphytosphingosine (
CHEBI:82842
)
is a
N
-acylphytosphingosine (
CHEBI:31998
)
IUPAC Name
N
-[(2
S
,3
S
,4
R
)-1,3,4-trihydroxyoctadecan-2-yl]octanamide
Synonyms
Sources
Cer(t18:0/8:0)
ChEBI
N
-capryloylphytosphingosine
SUBMITTER
N
-caprylylphytoceramide
SUBMITTER
N
-octanoyl-4-hydroxysphinganine
UniProt
Registry Number
Type
Source
9885224
Reaxys Registry Number
Reaxys
Last Modified
11 November 2014