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CHEBI:8642 - puromycin dihydrochloride

ChEBI IDCHEBI:8642
ChEBI Namepuromycin dihydrochloride
Stars
DefinitionThe dihydrochloride salt of puromycin.
Last Modified19 January 2021
DownloadsMolfile
FormulaC22H29N7O5.2HCl
Net Charge0
Average Mass544.440
Monoisotopic Mass543.17637
SMILESCOc1ccc(C[C@H](N)C(=O)N[C@H]2[C@@H](O)[C@H](n3cnc4c(N(C)C)ncnc43)O[C@@H]2CO)cc1.Cl.Cl
InChIInChI=1S/C22H29N7O5.2ClH/c1-28(2)19-17-20(25-10-24-19)29(11-26-17)22-18(31)16(15(9-30)34-22)27-21(32)14(23)8-12-4-6-13(33-3)7-5-12;;/h4-7,10-11,14-16,18,22,30-31H,8-9,23H2,1-3H3,(H,27,32);2*1H/t14-,15+,16+,18+,22+;;/m0../s1
InChIKeyMKSVFGKWZLUTTO-FZFAUISWSA-N
ChEBI Ontology
Outgoing Relation(s)
puromycin dihydrochloride (CHEBI:8642) has part puromycin(1+) (CHEBI:60255)
puromycin dihydrochloride (CHEBI:8642) is a hydrochloride (CHEBI:36807)
IUPAC Name 
3'-deoxy-N,N-dimethyl-3'-[(O-methyl-L-tyrosyl)amino]adenosine dihydrochloride
Synonyms  Source
puromycin dihydrochlorideKEGG COMPOUND
puromycin hydrochlorideKEGG DRUG
3'-[α-amino-p-methoxyhydrocinnamamido]-3'-deoxy-N,N-dimethyladenosine dihydrochlorideChEBI
Manual XrefsDatabases
C11618KEGG COMPOUND
D05655KEGG DRUG
Registry NumbersSources
Reaxys:3853613Reaxys
CAS:58-58-2ChemIDplus
Citations