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CHEBI:75665 - (2S,3R)-capreomycidine(1+)

ChEBI IDCHEBI:75665
ChEBI Name(2S,3R)-capreomycidine(1+)
Stars
ASCII Name(2S,3R)-capreomycidine(1+)
DefinitionAn α-amino-acid cation obtained by deprotonation of the carboxy group and protonation of the amino and guanidino groups of (2S,3R)-capreomycidine.
Last Modified8 October 2013
SubmitterKAX
DownloadsMolfile
FormulaC6H13N4O2
Net Charge+1
Average Mass173.196
Monoisotopic Mass173.10330
SMILES[H][C@]1([C@H]([NH3+])C(=O)[O-])CCNC(=[NH2+])N1
InChIInChI=1S/C6H12N4O2/c7-4(5(11)12)3-1-2-9-6(8)10-3/h3-4H,1-2,7H2,(H,11,12)(H3,8,9,10)/p+1/t3-,4+/m1/s1
InChIKeyXHNWDEHKMJLKGG-DMTCNVIQSA-O
ChEBI Ontology
Outgoing Relation(s)
(2S,3R)-capreomycidine(1+) (CHEBI:75665) is a α-amino-acid cation (CHEBI:33719)
(2S,3R)-capreomycidine(1+) (CHEBI:75665) is conjugate acid of (2S,3R)-capreomycidine (CHEBI:75851)
Incoming Relation(s)
(2S,3R)-capreomycidine (CHEBI:75851) is conjugate base of (2S,3R)-capreomycidine(1+) (CHEBI:75665)
IUPAC Name 
(2S)-azaniumyl[(4R)-2-iminiohexahydropyrimidin-4-yl]acetate
UniProt Name  Source
(2S,3R)-capreomycidineUniProt
Manual XrefsDatabases
CPD-15414MetaCyc
Citations