input word = C00013844

Metabolite InformationStructural formula
Name Quercetin 3-rhamnoside-3'-glucoside
3-[(6-deoxy-alpha-L-mannopyranosyl)oxy]-2-[3-(beta-D-glucopyranosyloxy)-4-hydroxyphenyl]-5,7-dihydroxy-4H-1-benzopyran-4-one
Formula C27H30O16
Mw 610.15338491
CAS RN 200353-66-8
C_ID C00013844 ,
InChIKey HQDURBOTRVCWOY-ITIRTPILNA-N
InChICode InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(39-8)43-25-19(34)16-12(31)5-10(29)6-14(16)40-24(25)9-2-3-11(30)13(4-9)41-27-23(38)21(36)18(33)15(7-28)42-27/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15-,17-,18+,20+,21-,22-,23+,26-,27+/m0/s1
SMILES CC1O[C@@H](Oc2c(-c3ccc(O)c(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H](O)C(O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyrsinaceaeMyrsine seguinii Ref.
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