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CHEBI:190936 - (r)-butaprost (free acid)

ChEBI IDCHEBI:190936
ChEBI Name(r)-butaprost (free acid)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H38O5
Net Charge0
Average Mass394.552
Monoisotopic Mass394.27192
SMILESCCCC1([C@H](O)C/C=C/[C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)O)CCC1
InChIInChI=1S/C23H38O5/c1-2-13-23(14-8-15-23)21(26)11-7-10-18-17(19(24)16-20(18)25)9-5-3-4-6-12-22(27)28/h7,10,17-18,20-21,25-26H,2-6,8-9,11-16H2,1H3,(H,27,28)/b10-7+/t17-,18-,20-,21-/m1/s1
InChIKeyPAYNQYXOKJDXAV-NMXQQJQMSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) INS-1 cell (BTO:0002135) MetaboLights (MTBLS3963)
ChEBI Ontology
Outgoing Relation(s)
(r)-butaprost (free acid) (CHEBI:190936) is a prostanoid (CHEBI:26347)
IUPAC Name 
7-[(1R,2R,3R)-3-hydroxy-2-[(E,4R)-4-hydroxy-4-(1-propylcyclobutyl)but-1-enyl]-5-oxocyclopentyl]heptanoic acid
Manual XrefsDatabases
32820950ChemSpider