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CHEBI:756913 - bendamustine dodecyl ester

Default Structure
ChEBI IDCHEBI:756913
ChEBI Namebendamustine dodecyl ester
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC28H45Cl2N3O2
Net Charge0
Average Mass526.593
Monoisotopic Mass525.28888
SMILESCCCCCCCCCCCCOC(=O)CCCc1nc2cc(N(CCCl)CCCl)ccc2n1C
InChIInChI=1S/C28H45Cl2N3O2/c1-3-4-5-6-7-8-9-10-11-12-22-35-28(34)15-13-14-27-31-25-23-24(16-17-26(25)32(27)2)33(20-18-29)21-19-30/h16-17,23H,3-15,18-22H2,1-2H3
InChIKeyRJNURICEBYUKHL-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
bendamustine dodecyl ester (CHEBI:756913) has role antineoplastic agent (CHEBI:35610)
bendamustine dodecyl ester (CHEBI:756913) is a benzimidazoles (CHEBI:22715)
Synonyms  Source
Bendamustine dodecyl esterChEMBL
CEP-40125ChEMBL
RXDX-107ChEMBL