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CHEBI:184497 - Linoside B

ChEBI IDCHEBI:184497
ChEBI NameLinoside B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H36O15
Net Charge0
Average Mass636.603
Monoisotopic Mass636.20542
SMILES[H][C@@]1(c2c(OC)cc3oc(-c4ccc(OC)c(OC)c4)cc(=O)c3c2O)OC(CO)[C@@H](O)[C@H](O)C1O[C@@H]1OC(C)[C@H](O)[C@H](O)C1O
InChIInChI=1S/C30H36O15/c1-11-22(33)25(36)27(38)30(42-11)45-29-26(37)23(34)19(10-31)44-28(29)21-17(41-4)9-18-20(24(21)35)13(32)8-15(43-18)12-5-6-14(39-2)16(7-12)40-3/h5-9,11,19,22-23,25-31,33-38H,10H2,1-4H3/t11?,19?,22-,23+,25-,26-,27?,28-,29?,30-/m0/s1
InChIKeySHCSQYSECQXBOS-VBSVIYIXSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Linoside B (CHEBI:184497) is a C-glycosyl compound (CHEBI:20857)
Linoside B (CHEBI:184497) is a flavonoids (CHEBI:72544)
IUPAC Name 
6-[(2S,4S,5S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-2-(3,4-dimethoxyphenyl)-5-hydroxy-7-methoxychromen-4-one
Manual XrefsDatabases
LMPK12111059LIPID MAPS
24844011ChemSpider