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CHEBI:196982 - Kaempferol 3-glucosyl-(1->6)-galactoside

Default Structure
ChEBI IDCHEBI:196982
ChEBI NameKaempferol 3-glucosyl-(1->6)-galactoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H30O16
Net Charge0
Average Mass610.521
Monoisotopic Mass610.15338
SMILESO=c1c(O[C@@H]2OC(CO[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)[C@H](O)C(O)C2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
InChIInChI=1S/C27H30O16/c28-7-14-17(32)20(35)22(37)26(41-14)39-8-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-12(31)5-11(30)6-13(16)40-24(25)9-1-3-10(29)4-2-9/h1-6,14-15,17-18,20-23,26-33,35-38H,7-8H2/t14?,15?,17-,18+,20+,21?,22?,23?,26-,27+/m1/s1
InChIKeyBITPRCODIALMOV-ZUHAHAJGSA-N
Species of MetaboliteComponentSourceComments
Cannabis sativa (ncbitaxon:3483) inflorescence (BTO:0000628) MetaboLights (MTBLS6032) Strain: Cannabis sativa var. DMG265
ChEBI Ontology
Outgoing Relation(s)
Kaempferol 3-glucosyl-(1->6)-galactoside (CHEBI:196982) is a flavonoids (CHEBI:72544)
Kaempferol 3-glucosyl-(1->6)-galactoside (CHEBI:196982) is a glycoside (CHEBI:24400)
IUPAC Name 
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,5R)-3,4,5-trihydroxy-6-[[(2R,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
Manual XrefsDatabases
24844412ChemSpider
LMPK12111667LIPID MAPS