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CHEBI:85899 - 4-pregnen-3β-ol-20-one
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ChEBI Name
4-pregnen-3β-ol-20-one
ChEBI ID
CHEBI:85899
ChEBI ASCII Name
4-pregnen-3beta-ol-20-one
Definition
A 3β-hydroxy steroid that is 4-pregnen-3β-ol substituted by an oxo group at position 20.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Nevila Nouspikel
Supplier Information
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Formula
C21H32O2
Net Charge
0
Average Mass
316.47760
Monoisotopic Mass
316.24023
InChI
InChI=1S/C21H32O2/c1-
13(22)
17-
6-
7-
18-
16-
5-
4-
14-
12-
15(23)
8-
10-
20(14,2)
19(16)
9-
11-
21(17,18)
3/h12,15-
19,23H,4-
11H2,1-
3H3/t15-
,16-
,17+,18-
,19-
,20-
,21+/m0/s1
InChIKey
QWVWXRKHAXWWSV-QGVNFLHTSA-N
SMILES
CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
ChEBI Ontology
Outgoing
4-pregnen-3β-ol-20-one (
CHEBI:85899
)
has functional parent
progesterone (
CHEBI:17026
)
4-pregnen-3β-ol-20-one (
CHEBI:85899
)
is a
20-oxo steroid (
CHEBI:36885
)
4-pregnen-3β-ol-20-one (
CHEBI:85899
)
is a
3β-hydroxy steroid (
CHEBI:36836
)
4-pregnen-3β-ol-20-one (
CHEBI:85899
)
is a
C
21
-steroid (
CHEBI:61313
)
IUPAC Name
3β-hydroxypregn-4-ene-20-one
Synonyms
Sources
(3β)-3-hydroxypregn-4-en-20-one
IUPAC
3β-hydroxypregn-4-ene-20-one
UniProt
Registry Number
Type
Source
3102811
Reaxys Registry Number
Reaxys
Citation
Type
Source
12574203
PubMed citation
SUBMITTER
Last Modified
17 January 2023