input word = C00005390

Metabolite InformationStructural formula
Name Quercetin 3-rhamnosyl-(1->2)-alpha-L-arabinopyranoside
Formula C26H28O15
Mw 580.14282023
CAS RN 86749-52-2
C_ID C00005390 ,
InChIKey IKTXLMAFUIXYTI-SYDKGNIDNA-N
InChICode InChI=1S/C26H28O15/c1-8-17(32)20(35)21(36)25(38-8)41-24-18(33)14(31)7-37-26(24)40-23-19(34)16-13(30)5-10(27)6-15(16)39-22(23)9-2-3-11(28)12(29)4-9/h2-6,8,14,17-18,20-21,24-33,35-36H,7H2,1H3/t8-,14+,17-,18+,20+,21-,24+,25-,26+/m0/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@@H]1[C@@H]([C@@H]([C@@H](CO1)O)O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)C)c1ccc(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeBrassica nigra Ref.
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