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ChEBI
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CHEBI:59237 - phenolic phthiocerol
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ChEBI Name
phenolic phthiocerol
ChEBI ID
CHEBI:59237
Definition
A lipid derived from phthiocerol, having a 4-hydroxyphenyl substituent at the 29-position.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C37H68O4
Net Charge
0
Average Mass
576.93340
Monoisotopic Mass
576.51176
InChI
InChI=1S/C37H68O4/c1-
4-
37(41-
3)
32(2)
23-
21-
22-
26-
36(40)
31-
35(39)
25-
20-
18-
16-
14-
12-
10-
8-
6-
5-
7-
9-
11-
13-
15-
17-
19-
24-
33-
27-
29-
34(38)
30-
28-
33/h27-
30,32,35-
40H,4-
26,31H2,1-
3H3/t32-
,35+,36-
,37+/m1/s1
InChIKey
GDIGGEUWHKJEEK-IIVMXCGDSA-N
SMILES
CC[C@H](OC)[C@H](C)CCCC[C@@H](O)C[C@@H](O)CCCCCCCCCCCCCCCCCCc1ccc(O)cc1
Roles Classification
Biological Role
(s):
epitope
The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
phenolic phthiocerol (
CHEBI:59237
)
has parent hydride
phthiocerol A (
CHEBI:59240
)
phenolic phthiocerol (
CHEBI:59237
)
has role
epitope (
CHEBI:53000
)
phenolic phthiocerol (
CHEBI:59237
)
is a
phenols (
CHEBI:33853
)
phenolic phthiocerol (
CHEBI:59237
)
is a
phthiocerol derivatives (
CHEBI:189847
)
phenolic phthiocerol (
CHEBI:59237
)
is a
triol (
CHEBI:27136
)
Incoming
4-(18,20-dihydroxy-26-methoxy-25-methyloctacosyl)phenyl 3,6-di-
O
-methyl-β-
D
-Glc-(1→4)-2,3-di-
O
-methyl-α-
L
-Rha-(1→2)-3-
O
-methyl-α-
L
-Rha (
CHEBI:59236
)
has functional parent
phenolic phthiocerol (
CHEBI:59237
)
IUPAC Name
(3
S
,4
R
,9
R
,11
S
)-
29-
(4-
hydroxyphenyl)-
3-
methoxy-
4-
methylnonacosane-
9,11-
diol
Citation
Type
Source
6193065
PubMed citation
Europe PMC
Last Modified
23 February 2022