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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:3898 - Cortol
Main
ChEBI Ontology
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ChEBI Name
Cortol
ChEBI ID
CHEBI:3898
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Molfile
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Formulae
C21H36O5
C21H36O5
Net Charge
0
Average Mass
368.508
Monoisotopic Mass
368.25627
InChI
InChI=1S/C21H36O5/c1-
19-
7-
5-
13(23)
9-
12(19)
3-
4-
14-
15-
6-
8-
21(26,17(25)
11-
22)
20(15,2)
10-
16(24)
18(14)
19/h12-
18,22-
26H,3-
11H2,1-
2H3/t12-
,13-
,14+,15+,16+,17+,18-
,19+,20+,21+/m1/s1
InChIKey
FFPUNPBUZDTHJI-XPOJVAQCSA-N
SMILES
C[C@]12C[C@H](O)[C@H]3[C@@H](CC[C@@H]4C[C@H](O)CC[C@]34C)[C@@H]1CC[C@]2(O)[C@@H](O)CO
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
Found in urine
(BTO:0001419)
. See:
PubMed
ChEBI Ontology
Outgoing
Cortol (
CHEBI:3898
)
is a
21-hydroxy steroid (
CHEBI:35344
)
Synonyms
Sources
(1S,2S,5R,7R,10S,11S,14R,15S,17S)-
14-
[(1S)-
1,2-
dihydroxyethyl]-
2,15-
dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecane-
5,14,17-
triol
HMDB
20alpha-Cortol
HMDB
3alpha,11beta,17,20alpha,21-Pentahydroxypregnane
HMDB
5beta-Pregnane-3alpha,11beta,17,20,21-pentol
HMDB
alpha-Cortol
HMDB
Cortol
KEGG COMPOUND
Manual Xrefs
Databases
C05482
KEGG COMPOUND
CORTOL
MetaCyc
HMDB0003180
HMDB
View more database links
Registry Number
Type
Source
516-38-1
CAS Registry Number
KEGG COMPOUND
Citations
Types
Sources
1172896
PubMed citation
Europe PMC
14643447
PubMed citation
Europe PMC
15560936
PubMed citation
Europe PMC
Last Modified
23 October 2015