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CHEBI:190395 - Nebramine

ChEBI IDCHEBI:190395
ChEBI NameNebramine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H26N4O5
Net Charge0
Average Mass306.363
Monoisotopic Mass306.19032
SMILESNC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](N)C[C@@H]2N)[C@H](N)C[C@@H]1O
InChIInChI=1S/C12H26N4O5/c13-3-8-7(17)2-6(16)12(20-8)21-11-5(15)1-4(14)9(18)10(11)19/h4-12,17-19H,1-3,13-16H2/t4-,5+,6-,7+,8-,9+,10-,11-,12-/m1/s1
InChIKeyQBWLTQZEVUXXSR-RROBTUQGSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS3854)
Streptoalloteichus tenebrarius (ncbitaxon:1933) - PubMed (965656)
ChEBI Ontology
Outgoing Relation(s)
Nebramine (CHEBI:190395) is a amino cyclitol (CHEBI:61689)
Nebramine (CHEBI:190395) is a glycoside (CHEBI:24400)
IUPAC Names 
(1S,2R,3R,4S,6R)-4,6-diamino-3-[(2R,3R,5S,6R)-3-amino-6-(aminomethyl)-5-hydroxyoxan-2-yl]oxycyclohexane-1,2-diol
4,6-diamino-3-[3-amino-6-(aminomethyl)-5-hydroxyoxan-2-yl]oxycyclohexane-1,2-diol
Manual XrefsDatabases
10292125ChemSpider
C21259KEGG COMPOUND
57440885ChemSpider
Registry NumbersSources
CAS:34051-04-2ChemIDplus