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CHEBI:177703 - Latanoprostene bunod

ChEBI IDCHEBI:177703
ChEBI NameLatanoprostene bunod
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H41NO8
Net Charge0
Average Mass507.624
Monoisotopic Mass507.28322
SMILESO=C(CCC/C=C\C[C@@H]1[C@@H](CC[C@@H](O)CCc2ccccc2)[C@H](O)C[C@@H]1O)OCCCCO[N+](=O)[O-]
InChIInChI=1S/C27H41NO8/c29-22(15-14-21-10-4-3-5-11-21)16-17-24-23(25(30)20-26(24)31)12-6-1-2-7-13-27(32)35-18-8-9-19-36-28(33)34/h1,3-6,10-11,22-26,29-31H,2,7-9,12-20H2/b6-1-/t22-,23+,24+,25-,26+/m0/s1
InChIKeyLOVMMUBRQUFEAH-UIEAZXIASA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) Sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
Latanoprostene bunod (CHEBI:177703) is a prostanoid (CHEBI:26347)
IUPAC Name 
4-nitrooxybutyl (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3R)-3-hydroxy-5-phenylpentyl]cyclopentyl]hept-5-enoate
Manual XrefsDatabases
9331546ChemSpider
DB11660DrugBank
5261DrugCentral
D10441KEGG DRUG
Registry NumbersSources
CAS:860005-21-6ChemIDplus