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CHEBI:135626 - gemeprost

ChEBI IDCHEBI:135626
ChEBI Namegemeprost
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC23H38O5
Net Charge0
Average Mass394.552
Monoisotopic Mass394.27192
SMILESCCCCC(C)(C)[C@H](O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCC/C=C/C(=O)OC
InChIInChI=1S/C23H38O5/c1-5-6-15-23(2,3)21(26)14-13-18-17(19(24)16-20(18)25)11-9-7-8-10-12-22(27)28-4/h10,12-14,17-18,20-21,25-26H,5-9,11,15-16H2,1-4H3/b12-10+,14-13+/t17-,18-,20-,21-/m1/s1
InChIKeyKYBOHGVERHWSSV-VNIVIJDLSA-N
ChEBI Ontology
Outgoing Relation(s)
gemeprost (CHEBI:135626) is a aliphatic alcohol (CHEBI:2571)
Synonyms  Source
cervagemeDrugCentral
cervagemDrugCentral
cergemDrugCentral
carprostDrugCentral
Manual XrefsDatabases
1284DrugCentral
Registry NumbersSources
CAS:64318-79-2DrugCentral