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 c1c(cc(c(c1)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)c1oc2c(c(=O)c1O[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)c(cc(c2)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyrsinaceaeMyrsine seguinii Ref.
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