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CHEBI:184679 - Artabotryside B

Default Structure
ChEBI IDCHEBI:184679
ChEBI NameArtabotryside B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H28O14
Net Charge0
Average Mass564.496
Monoisotopic Mass564.14791
SMILESCC1O[C@@H](O[C@H]2C(O)[C@H](CO)O[C@H]2Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)C(O)[C@H]1O
InChIInChI=1S/C26H28O14/c1-9-17(31)20(34)21(35)25(36-9)40-24-18(32)15(8-27)38-26(24)39-23-19(33)16-13(30)6-12(29)7-14(16)37-22(23)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-21,24-32,34-35H,8H2,1H3/t9?,15-,17-,18?,20?,21-,24-,25-,26-/m0/s1
InChIKeyNRVLSEXRPWZCQQ-LTQCZJDESA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Artabotryside B (CHEBI:184679) is a flavonoids (CHEBI:72544)
Artabotryside B (CHEBI:184679) is a glycoside (CHEBI:24400)
IUPAC Name 
5,7-dihydroxy-3-[(2S,3S,5S)-4-hydroxy-5-(hydroxymethyl)-3-[(2S,3S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxolan-2-yl]oxy-2-(4-hydroxyphenyl)chromen-4-one
Manual XrefsDatabases
24844648ChemSpider
LMPK12111906LIPID MAPS