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CHEBI:31355 - carboplatin

ChEBI IDCHEBI:31355
ChEBI Namecarboplatin
Stars
DefinitionA platinum coordination entity with cis square-planar geometry in which platinum(II) is coordinated to two ammonia ligands and a bidentate cyclobutane-1,1-dicarboxylate ligand.
Secondary ChEBI IDCHEBI:76407
Last Modified27 April 2021
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC6H12N2O4Pt
Net Charge0
Average Mass371.250
Monoisotopic Mass371.04450
SMILES[H][N]([H])([H])[Pt]1([N]([H])([H])[H])[O]C(=O)C2(CCC2)C(=O)[O]1
InChIInChI=1S/C6H8O4.2H3N.Pt/c7-4(8)6(5(9)10)2-1-3-6;;;/h1-3H2,(H,7,8)(H,9,10);2*1H3;/q;;;+2/p-2
InChIKeyOLESAACUTLOWQZ-UHFFFAOYSA-L
Wikipedia
Roles Classification
Biological Role:
mutagen  An agent that increases the frequency of mutations above the normal background level, usually by interacting directly with DNA and causing it damage, including base substitution.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
carboplatin (CHEBI:31355) has part cyclobutane-1,1-dicarboxylate(2−) (CHEBI:35690)
carboplatin (CHEBI:31355) has role antineoplastic agent (CHEBI:35610)
carboplatin (CHEBI:31355) has role mutagen (CHEBI:25435)
carboplatin (CHEBI:31355) is a platinum coordination entity (CHEBI:33862)
IUPAC Name 
(SP-4-2)-diammine[cyclobutane-1,1-dicarboxylato(2−)-κ2O,O']platinum
INNs  Source
carboplatinWHO MedNet
carboplatinumWHO MedNet
carboplatineWHO MedNet
carboplatinoWHO MedNet
Synonyms  Source
CarboplatinKEGG DRUG
ParaplatinChemIDplus
cis-(1,1-cyclobutanedicarboxylato)diammineplatinum(II)ChemIDplus
cis-diammine(1,1-cyclobutanedicarboxylato)platinum(II)ChemIDplus
cbdcaChemIDplus
cis-diammine(1,1-cyclobutanedicarboxylato)platinumChemIDplus
Manual XrefsDatabases
D01363KEGG DRUG
DB00958DrugBank
CarboplatinWikipedia
HMDB0015093HMDB
LSM-4265LINCS
QPTPDBeChem
DE2329485Patent
Registry NumbersSources
Gmelin:51428Gmelin
Gmelin:1044703Gmelin
Reaxys:11327310Reaxys
Reaxys:11335262Reaxys
Reaxys:15523471Reaxys
CAS:41575-94-4KEGG DRUG
CAS:41575-94-4ChemIDplus
Citations