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CHEBI:67213 - 2'-deamino-2'-hydroxyneamine(3+)

ChEBI IDCHEBI:67213
ChEBI Name2'-deamino-2'-hydroxyneamine(3+)
Stars
DefinitionAn organic cation obtained by protonation of the three amino groups of 2'-deamino-2'-hydroxyneamine; major species at pH 7.3.
Last Modified23 August 2024
SubmitterKAX
DownloadsMolfile
FormulaC12H28N3O7
Net Charge+3
Average Mass326.370
Monoisotopic Mass326.19108
SMILES[NH3+]C[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H]([NH3+])C[C@@H]2[NH3+])[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C12H25N3O7/c13-2-5-7(17)8(18)10(20)12(21-5)22-11-4(15)1-3(14)6(16)9(11)19/h3-12,16-20H,1-2,13-15H2/p+3/t3-,4+,5-,6+,7-,8+,9-,10-,11-,12-/m1/s1
InChIKeyAWRLKTYNEGEURZ-JCLMPDJQSA-Q
ChEBI Ontology
Outgoing Relation(s)
2'-deamino-2'-hydroxyneamine(3+) (CHEBI:67213) is a ammonium ion derivative (CHEBI:35274)
2'-deamino-2'-hydroxyneamine(3+) (CHEBI:67213) is a organic cation (CHEBI:25697)
2'-deamino-2'-hydroxyneamine(3+) (CHEBI:67213) is conjugate acid of 2'-deamino-2'-hydroxyneamine (CHEBI:67223)
Incoming Relation(s)
2'-deamino-2'-hydroxyneamine (CHEBI:67223) is conjugate base of 2'-deamino-2'-hydroxyneamine(3+) (CHEBI:67213)
IUPAC Name 
(1R,2R,3S,4R,6S)-4,6-diazaniumyl-2,3-dihydroxycyclohexyl 6-azaniumyl-6-deoxy-α-D-glucopyranoside
Synonym  Source
(1R,2R,3S,4R,6S)-4,6-diammonio-2,3-dihydroxycyclohexyl 6-ammonio-6-deoxy-α-D-glucopyranosideIUPAC
UniProt Name  Source
2'-deamino-2'-hydroxyneamineUniProt
Manual XrefsDatabases
CPD-14128MetaCyc
Citations