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ChEBI
> Main
CHEBI:79918 - 3beta-Hydroxy-5alpha-pregnan-20-one acetate
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ChEBI Ontology
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ChEBI Name
3beta-Hydroxy-5alpha-pregnan-20-one acetate
ChEBI ID
CHEBI:79918
Stars
This entity has been manually annotated by a third party.
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Formula
C23H36O3
Net Charge
0
Average Mass
360.53010
Monoisotopic Mass
360.26645
InChI
InChI=1S/C23H36O3/c1-
14(24)
19-
7-
8-
20-
18-
6-
5-
16-
13-
17(26-
15(2)
25)
9-
11-
22(16,3)
21(18)
10-
12-
23(19,20)
4/h16-
21H,5-
13H2,1-
4H3/t16-
,17-
,18-
,19+,20-
,21-
,22-
,23+/m0/s1
InChIKey
GFHOQCXDABGYAL-POBGKJHXSA-N
SMILES
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@H](C(C)=O)[C@@]4(C)CC[C@H]23)C1
ChEBI Ontology
Outgoing
3beta-Hydroxy-5alpha-pregnan-20-one acetate (
CHEBI:79918
)
is a
steroid ester (
CHEBI:47880
)
Synonym
Source
3beta-Acetoxy-5alpha-pregnan-20-one
KEGG COMPOUND
Manual Xref
Database
C15417
KEGG COMPOUND
View more database links