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CHEBI:749087 - ombrabulin

Default Structure
ChEBI IDCHEBI:749087
ChEBI Nameombrabulin
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC21H26N2O6
Net Charge0
Average Mass402.447
Monoisotopic Mass402.17909
SMILESCOc1ccc(/C=C\c2cc(OC)c(OC)c(OC)c2)cc1NC(=O)[C@@H](N)CO
InChIInChI=1S/C21H26N2O6/c1-26-17-8-7-13(9-16(17)23-21(25)15(22)12-24)5-6-14-10-18(27-2)20(29-4)19(11-14)28-3/h5-11,15,24H,12,22H2,1-4H3,(H,23,25)/b6-5-/t15-/m0/s1
InChIKeyIXWNTLSTOZFSCM-YVACAVLKSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
ombrabulin (CHEBI:749087) has role antineoplastic agent (CHEBI:35610)
ombrabulin (CHEBI:749087) is a stilbenoid (CHEBI:26776)
INNs  Source
ombrabulinWHO MedNet
ombrabulinaWHO MedNet
ombrabulineWHO MedNet
Synonyms  Source
AC7700ChEMBL
AVE-8062ChEMBL
AVE8062ChEMBL
Citations