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CHEBI:60255 - puromycin(1+)

ChEBI IDCHEBI:60255
ChEBI Namepuromycin(1+)
Stars
DefinitionPuromycin monoprotonated at the amino nitrogen. It is the predominant species at pH 7.3.
Last Modified19 January 2021
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC22H30N7O5
Net Charge+1
Average Mass472.526
Monoisotopic Mass472.23029
SMILESCOc1ccc(C[C@H]([NH3+])C(=O)N[C@H]2[C@@H](O)[C@H](n3cnc4c(N(C)C)ncnc43)O[C@@H]2CO)cc1
InChIInChI=1S/C22H29N7O5/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)/p+1/t14-,15+,16+,18+,22+/m0/s1
InChIKeyRXWNCPJZOCPEPQ-NVWDDTSBSA-O
ChEBI Ontology
Outgoing Relation(s)
puromycin(1+) (CHEBI:60255) is a organic cation (CHEBI:25697)
puromycin(1+) (CHEBI:60255) is conjugate acid of puromycin (CHEBI:17939)
Incoming Relation(s)
puromycin dihydrochloride (CHEBI:8642) has part puromycin(1+) (CHEBI:60255)
puromycin (CHEBI:17939) is conjugate base of puromycin(1+) (CHEBI:60255)
IUPAC Name 
3'-{[(2S)-2-azaniumyl-3-(4-methoxyphenyl)propanoyl]amino}-3'-deoxy-N,N-dimethyladenosine
Synonym  Source
3'-{[(2S)-2-ammonio-3-(4-methoxyphenyl)propanoyl]amino}-3'-deoxy-N,N-dimethyladenosineIUPAC
UniProt Name  Source
puromycinUniProt