EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:168567 - Kinetin-7-N-glucoside

Default Structure
ChEBI IDCHEBI:168567
ChEBI NameKinetin-7-N-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H19N5O6
Net Charge0
Average Mass377.357
Monoisotopic Mass377.13353
SMILESOC[C@H]1O[C@H](n2cnc3ncnc(NCc4ccco4)c32)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C16H19N5O6/c22-5-9-11(23)12(24)13(25)16(27-9)21-7-20-15-10(21)14(18-6-19-15)17-4-8-2-1-3-26-8/h1-3,6-7,9,11-13,16,22-25H,4-5H2,(H,17,18,19)/t9-,11-,12+,13-,16+/m1/s1
InChIKeyAXJIOWGMASZFOU-HMXKMONRSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Kinetin-7-N-glucoside (CHEBI:168567) is a N-glycosyl compound (CHEBI:21731)
IUPAC Name 
(2S,3R,4S,5S,6R)-2-[6-(uran-2-ylmethylamino)purin-7-yl]-6-(hydroxymethyl)oxane-3,4,5-triol
Manual XrefsDatabases
30776606ChemSpider
HMDB0012243HMDB