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CHEBI:759606 - dsp-0390

Default Structure
ChEBI IDCHEBI:759606
ChEBI Namedsp-0390
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC23H30ClN3O2
Net Charge0
Average Mass415.965
Monoisotopic Mass415.20265
SMILES[H][C@@]12OCC3(CCN(CCn4ccnc4)CC3)C[C@@]1([H])C(C)(C)Oc1cc(Cl)ccc12
InChIInChI=1S/C23H30ClN3O2/c1-22(2)19-14-23(5-8-26(9-6-23)11-12-27-10-7-25-16-27)15-28-21(19)18-4-3-17(24)13-20(18)29-22/h3-4,7,10,13,16,19,21H,5-6,8-9,11-12,14-15H2,1-2H3/t19-,21+/m1/s1
InChIKeyQKAZUVQTHFXMLS-CTNGQTDRSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
dsp-0390 (CHEBI:759606) has role antineoplastic agent (CHEBI:35610)
dsp-0390 (CHEBI:759606) is a 1-benzopyran (CHEBI:38443)
Synonym  Source
Dsp-0390ChEMBL