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CHEBI:185631 - Sachaliside 2

ChEBI IDCHEBI:185631
ChEBI NameSachaliside 2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H32O12
Net Charge0
Average Mass584.574
Monoisotopic Mass584.18938
SMILESOCC1O[C@@H](Oc2cc3c(c(O)c2C/C=C/c2ccc(O)cc2)C[C@H](O)[C@@H](c2ccc(O)c(O)c2)O3)C(O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C30H32O12/c31-13-24-26(37)27(38)28(39)30(42-24)41-22-12-23-18(11-21(35)29(40-23)15-6-9-19(33)20(34)10-15)25(36)17(22)3-1-2-14-4-7-16(32)8-5-14/h1-2,4-10,12,21,24,26-39H,3,11,13H2/b2-1+/t21-,24?,26+,27-,28?,29+,30+/m0/s1
InChIKeyDUZQFCJYWSXVJS-UEFZQHQLSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Sachaliside 2 (CHEBI:185631) is a flavonoids (CHEBI:72544)
Sachaliside 2 (CHEBI:185631) is a glycoside (CHEBI:24400)
IUPAC Name 
(2S,4S,5S)-2-[[(2R,3S)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6-[(E)-3-(4-hydroxyphenyl)prop-2-enyl]-3,4-dihydro-2H-chromen-7-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Manual XrefsDatabases
LMPK12020045LIPID MAPS
24842522ChemSpider