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CHEBI:758211 - ip-2018

Default Structure
ChEBI IDCHEBI:758211
ChEBI Nameip-2018
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC16H17NO3
Net Charge0
Average Mass271.316
Monoisotopic Mass271.12084
SMILESO=c1ccc2ccc(O[C@@H]3C[C@H]4CC[C@@H](C3)N4)cc2o1
InChIInChI=1S/C16H17NO3/c18-16-6-2-10-1-5-13(9-15(10)20-16)19-14-7-11-3-4-12(8-14)17-11/h1-2,5-6,9,11-12,14,17H,3-4,7-8H2/t11-,12+,14-
InChIKeyPGUDASZQLOAZRX-DABQJJPHSA-N
Roles Classification
Application:
vasodilator agent  A drug used to cause dilation of the blood vessels.
ChEBI Ontology
Outgoing Relation(s)
ip-2018 (CHEBI:758211) has role vasodilator agent (CHEBI:35620)
ip-2018 (CHEBI:758211) is a coumarins (CHEBI:23403)
Synonyms  Source
IP-2018ChEMBL
IP2018ChEMBL