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CHEBI:189510 - Apigenin 7-O-(2G-rhamnosyl)gentiobioside

ChEBI IDCHEBI:189510
ChEBI NameApigenin 7-O-(2G-rhamnosyl)gentiobioside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H40O19
Net Charge0
Average Mass740.664
Monoisotopic Mass740.21638
SMILESCC1OC(OC2C(Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)OC(COC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O
InChIInChI=1S/C33H40O19/c1-11-22(38)25(41)29(45)32(47-11)52-30-27(43)24(40)20(10-46-31-28(44)26(42)23(39)19(9-34)50-31)51-33(30)48-14-6-15(36)21-16(37)8-17(49-18(21)7-14)12-2-4-13(35)5-3-12/h2-8,11,19-20,22-36,38-45H,9-10H2,1H3
InChIKeyLXOPDILLGIDKLW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) leaf sheath (BTO:0005094) MetaboLights (MTBLS3518)
ChEBI Ontology
Outgoing Relation(s)
Apigenin 7-O-(2G-rhamnosyl)gentiobioside (CHEBI:189510) is a flavonoids (CHEBI:72544)
Apigenin 7-O-(2G-rhamnosyl)gentiobioside (CHEBI:189510) is a glycoside (CHEBI:24400)
IUPAC Name 
7-[4,5-dihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one