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CHEBI:31650 - Gestonorone caproate

Default Structure
ChEBI IDCHEBI:31650
ChEBI NameGestonorone caproate
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC26H38O4
Net Charge0
Average Mass414.586
Monoisotopic Mass414.27701
SMILES[H][C@@]12CCC3=CC(=O)CC[C@]3([H])[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1(OC(=O)CCCCC)C(C)=O
InChIInChI=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
InChIKeyXURCMZMFZXXQDJ-UKNJCJGYSA-N
ChEBI Ontology
Outgoing Relation(s)
Gestonorone caproate (CHEBI:31650) is a organic molecular entity (CHEBI:50860)
INNs  Source
caproate de gestonoroneWHO MedNet
caproato de gestonoronaWHO MedNet
Synonyms  Source
Gestonorone caproateKEGG COMPOUND
gestonorone capronateDrugCentral
Gestonorone hexanoateChEMBL
GestronolChEMBL
gestronol caproateDrugCentral
gestronol hexanoateDrugCentral
Brand Name  Source
DepostatChEMBL
Manual XrefsDatabases
3261DrugCentral
D01159KEGG DRUG
Registry NumbersSources
CAS:1253-28-7KEGG COMPOUND