CHEBI:177703 - Latanoprostene bunod

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Latanoprostene bunod
ChEBI ID CHEBI:177703
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C27H41NO8
Net Charge 0
Average Mass 507.624
Monoisotopic Mass 507.28322
InChI InChI=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
InChIKey LOVMMUBRQUFEAH-UIEAZXIASA-N
SMILES O[C@H]1[C@@H]([C@H]([C@@H](O)C1)C/C=C\CCCC(OCCCCO[N+]([O-])=O)=O)CC[C@@H](O)CCC2=CC=CC=C2
Metabolite of Species Details
Sus scrofa (NCBI:txid9823) Found in Sausage (ENVO:00002166). See: MetaboLights Study
ChEBI Ontology
Outgoing 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 Xrefs Databases
5261 DrugCentral
9331546 ChemSpider
D10441 KEGG DRUG
DB11660 KEGG DRUG
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Registry Number Type Source
860005-21-6 CAS Registry Number ChemIDplus