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CHEBI:94648 - LSM-5621

ChEBI IDCHEBI:94648
ChEBI NameLSM-5621
Stars
Last Modified3 June 2016
DownloadsMolfile
FormulaC15H18N4O5
Net Charge0
Average Mass334.332
Monoisotopic Mass334.12772
SMILESCO[C@]12[C@H](COC(N)=O)C3=C(C(=O)C(C)=C(N)C3=O)N1C[C@@H]1N[C@@H]12
InChIInChI=1S/C15H18N4O5/c1-5-9(16)12(21)8-6(4-24-14(17)22)15(23-2)13-7(18-13)3-19(15)10(8)11(5)20/h6-7,13,18H,3-4,16H2,1-2H3,(H2,17,22)/t6-,7+,13+,15+/m1/s1
InChIKeyNWIBSHFKIJFRCO-CDOIZDJWSA-N
Roles Classification
Biological Roles:
intercalator  A role played by a chemical agent which exhibits the capability of occupying space between DNA base pairs due to particular properties in size, shape and charge. Intercalation of chemical compounds in DNA helix can result in replication errors (shift, mutation) or DNA damages.
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
LSM-5621 (CHEBI:94648) is a mitomycin (CHEBI:25357)
Manual XrefsDatabases
LSM-5621LINCS