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ChEBI
> Main
CHEBI:77624 - 1-palmitoyl-3-stearoyl-
sn
-glycerol
Main
ChEBI Ontology
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ChEBI Name
1-palmitoyl-3-stearoyl-
sn
-glycerol
ChEBI ID
CHEBI:77624
ChEBI ASCII Name
1-palmitoyl-3-stearoyl-sn-glycerol
Definition
A 1,3-diglyceride in which the 1- and 3-acyl groups are specified as palmitoyl and stearoyl respectively (the
R
-enantiomer).
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Nevila Nouspikel
Supplier Information
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Molfile
XML
SDF
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Molfile
Formula
C37H72O5
Net Charge
0
Average Mass
596.96460
Monoisotopic Mass
596.53798
InChI
InChI=1S/C37H72O5/c1-
3-
5-
7-
9-
11-
13-
15-
17-
18-
20-
22-
24-
26-
28-
30-
32-
37(40)
42-
34-
35(38)
33-
41-
36(39)
31-
29-
27-
25-
23-
21-
19-
16-
14-
12-
10-
8-
6-
4-
2/h35,38H,3-
34H2,1-
2H3/t35-
/m1/s1
InChIKey
BFTGWUUHOMAGPO-PGUFJCEWSA-N
SMILES
CCCCCCCCCCCCCCCCCC(=O)OC[C@H](O)COC(=O)CCCCCCCCCCCCCCC
Roles Classification
Biological Role
(s):
Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (
Saccharomyces cerevisiae
).
(via
diglyceride
)
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
(via
diglyceride
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
1-palmitoyl-3-stearoyl-
sn
-glycerol (
CHEBI:77624
)
has functional parent
hexadecanoic acid (
CHEBI:15756
)
1-palmitoyl-3-stearoyl-
sn
-glycerol (
CHEBI:77624
)
has functional parent
octadecanoic acid (
CHEBI:28842
)
1-palmitoyl-3-stearoyl-
sn
-glycerol (
CHEBI:77624
)
is a
1,3-diglyceride (
CHEBI:47777
)
IUPAC Name
(2
R
)-3-(hexadecanoyloxy)2-hydroxypropyl octadecanoate
Synonyms
Sources
(2
R
)-2-hydroxy-3-(palmitoyloxy)propyl stearate
IUPAC
1-hexadecanoyl-3-octadecanoyl-
sn
-glycerol
UniProt
DAG(16:0/0:0/18:0)
HMDB
DAG(34:0)
HMDB
DG(16:0/0:0/18:0)
HMDB
DG(34:0)
HMDB
Diacylglycerol(16:0/0:0/18:0)
HMDB
Diacylglycerol(34:0)
HMDB
Manual Xref
Database
HMDB0056010
HMDB
View more database links
Citation
Type
Source
9442064
PubMed citation
SUBMITTER
Last Modified
16 April 2014