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CHEBI:748858 - rosabulin

Default Structure
ChEBI IDCHEBI:748858
ChEBI Namerosabulin
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC22H16N4O2S
Net Charge0
Average Mass400.463
Monoisotopic Mass400.09940
SMILESCc1cc(NC(=O)C(=O)c2cc(Cc3ccc(C#N)cc3)n3ccccc23)sn1
InChIInChI=1S/C22H16N4O2S/c1-14-10-20(29-25-14)24-22(28)21(27)18-12-17(26-9-3-2-4-19(18)26)11-15-5-7-16(13-23)8-6-15/h2-10,12H,11H2,1H3,(H,24,28)
InChIKeyIZZYUABKZYIINT-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
rosabulin (CHEBI:748858) has role antineoplastic agent (CHEBI:35610)
rosabulin (CHEBI:748858) is a indolizines (CHEBI:38485)
INNs  Source
rosabulinWHO MedNet
rosabulinaWHO MedNet
rosabulineWHO MedNet
Synonym  Source
STA-5312ChEMBL
Citations