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> Main
CHEBI:16524 - testosterone acetate
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ChEBI Ontology
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ChEBI Name
testosterone acetate
ChEBI ID
CHEBI:16524
Definition
An androstanoid that is the acetate derivative of testosterone.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:15215, CHEBI:26884, CHEBI:9462
Supplier Information
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Formula
C21H30O3
Net Charge
0
Average Mass
330.46110
Monoisotopic Mass
330.21949
InChI
InChI=1S/C21H30O3/c1-
13(22)
24-
19-
7-
6-
17-
16-
5-
4-
14-
12-
15(23)
8-
10-
20(14,2)
18(16)
9-
11-
21(17,19)
3/h12,16-
19H,4-
11H2,1-
3H3/t16-
,17-
,18-
,19-
,20-
,21-
/m0/s1
InChIKey
DJPZSBANTAQNFN-PXQJOHHUSA-N
SMILES
[H][C@@]12CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])OC(C)=O
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
See:
PubMed
Roles Classification
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
testosterone acetate (
CHEBI:16524
)
has functional parent
testosterone (
CHEBI:17347
)
testosterone acetate (
CHEBI:16524
)
has role
human metabolite (
CHEBI:77746
)
testosterone acetate (
CHEBI:16524
)
is a
3-oxo-Δ
4
steroid (
CHEBI:47909
)
testosterone acetate (
CHEBI:16524
)
is a
androstanoid (
CHEBI:50402
)
testosterone acetate (
CHEBI:16524
)
is a
sterol ester (
CHEBI:35915
)
IUPAC Name
3-oxoandrost-4-en-17β-yl acetate
Synonyms
Sources
17β-acetoxy-4-androsten-3-one
NIST Chemistry WebBook
17β-acetoxy-Δ
4
-androstan-3-one
NIST Chemistry WebBook
17β-hydroxyandrost-4-en-3-one acetate
NIST Chemistry WebBook
testosterone 17-acetate
ChemIDplus
Testosterone acetate
KEGG COMPOUND
testosterone acetate
UniProt
Manual Xrefs
Databases
C03027
KEGG COMPOUND
CPD-271
MetaCyc
LMST02020057
LIPID MAPS
View more database links
Registry Numbers
Types
Sources
1045-69-8
CAS Registry Number
KEGG COMPOUND
1045-69-8
CAS Registry Number
ChemIDplus
1045-69-8
CAS Registry Number
NIST Chemistry WebBook
2062555
Reaxys Registry Number
Reaxys
2062555
Beilstein Registry Number
Beilstein
969611
Gmelin Registry Number
Gmelin
Citations
Types
Sources
15625768
PubMed citation
Europe PMC
21742131
PubMed citation
Europe PMC
24713476
PubMed citation
Europe PMC
Last Modified
13 November 2017