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CHEBI:193250 - Sutchuenoside A

Default Structure
ChEBI IDCHEBI:193250
ChEBI NameSutchuenoside A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H32O15
Net Charge0
Average Mass620.560
Monoisotopic Mass620.17412
SMILESCC(=O)O[C@H]1C(C)O[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O[C@@H]4OC(C)[C@H](O)[C@H](O)C4O)cc(O)c3c2=O)[C@@H](O)C1O
InChIInChI=1S/C29H32O15/c1-10-19(33)21(35)23(37)28(39-10)42-15-8-16(32)18-17(9-15)43-26(13-4-6-14(31)7-5-13)27(20(18)34)44-29-24(38)22(36)25(11(2)40-29)41-12(3)30/h4-11,19,21-25,28-29,31-33,35-38H,1-3H3/t10?,11?,19-,21-,22?,23?,24-,25-,28-,29+/m0/s1
InChIKeyBNUCXCGZTSEDGK-YTOAEBAASA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
Sutchuenoside A (CHEBI:193250) is a flavonoids (CHEBI:72544)
Sutchuenoside A (CHEBI:193250) is a glycoside (CHEBI:24400)
IUPAC Name 
[(3R,5S,6R)-4,5-dihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-7-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-3-yl]oxy-2-methyloxan-3-yl] acetate
Manual XrefsDatabases
24844643ChemSpider
LMPK12111901LIPID MAPS