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ChEBI
> Main
CHEBI:31650 - Gestonorone caproate
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ChEBI Ontology
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ChEBI Name
Gestonorone caproate
ChEBI ID
CHEBI:31650
Stars
This entity has been manually annotated by a third party.
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Formulae
C26H38O4
C26H38O4
Net Charge
0
Average Mass
414.579
Monoisotopic Mass
414.27701
InChI
InChI=1S/C26H38O4/c1-
4-
5-
6-
7-
24(29)
30-
26(17(2)
27)
15-
13-
23-
22-
10-
8-
18-
16-
19(28)
9-
11-
20(18)
21(22)
12-
14-
25(23,26)
3/h16,20-
23H,4-
15H2,1-
3H3/t20-
,21+,22+,23-
,25-
,26-
/m0/s1
InChIKey
XURCMZMFZXXQDJ-UKNJCJGYSA-N
SMILES
O(C(CCCCC)
=O)
[C@@]
1(C(C)
=O)
[C@]
2(C)
[C@@]
(CC1)
([C@]
3([C@]
(CC2)
([C@@]
4(C(CC3)
=CC(CC4)
=O)
[H]
)
[H]
)
[H]
)
[H]
ChEBI Ontology
Outgoing
Gestonorone caproate (
CHEBI:31650
)
is a
organic molecular entity (
CHEBI:50860
)
Synonyms
Sources
Gestonorone caproate
KEGG COMPOUND
gestonorone capronate
DrugCentral
gestronol caproate
DrugCentral
gestronol hexanoate
DrugCentral
Manual Xrefs
Databases
3261
DrugCentral
D01159
KEGG DRUG
View more database links
Registry Number
Type
Source
1253-28-7
CAS Registry Number
KEGG COMPOUND
Last Modified
22 February 2017