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> Main
CHEBI:79766 - 17β-hydroxy-5α-androstane acetate
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ChEBI Name
17β-hydroxy-5α-androstane acetate
ChEBI ID
CHEBI:79766
ChEBI ASCII Name
17beta-hydroxy-5alpha-androstane acetate
Definition
A steroid ester that is 5α-androstane substituted by an acetoxy group at position 17.
Stars
This entity has been manually annotated by the ChEBI Team.
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Molfile
Formula
C21H34O2
Net Charge
0
Average Mass
318.49350
Monoisotopic Mass
318.25588
InChI
InChI=1S/C21H34O2/c1-
14(22)
23-
19-
10-
9-
17-
16-
8-
7-
15-
6-
4-
5-
12-
20(15,2)
18(16)
11-
13-
21(17,19)
3/h15-
19H,4-
13H2,1-
3H3/t15-
,16+,17+,18+,19+,20+,21+/m1/s1
InChIKey
QRRJQHVSHGOFLL-MQWPULPWSA-N
SMILES
CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CCCC[C@]4(C)[C@H]3CC[C@]12C
ChEBI Ontology
Outgoing
17β-hydroxy-5α-androstane acetate (
CHEBI:79766
)
has parent hydride
5α-androstane (
CHEBI:28859
)
17β-hydroxy-5α-androstane acetate (
CHEBI:79766
)
is a
acetate ester (
CHEBI:47622
)
17β-hydroxy-5α-androstane acetate (
CHEBI:79766
)
is a
androstanoid (
CHEBI:50402
)
17β-hydroxy-5α-androstane acetate (
CHEBI:79766
)
is a
steroid ester (
CHEBI:47880
)
IUPAC Name
(5α)-androstan-17β-yl acetate
Synonym
Source
17beta-Acetoxy-5alpha-androstane
KEGG COMPOUND
Manual Xref
Database
C15264
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
1236-49-3
CAS Registry Number
ChemIDplus
2470027
Reaxys Registry Number
Reaxys
Citation
Type
Source
5742873
PubMed citation
Europe PMC
Last Modified
03 March 2015