input word = C00014413

Metabolite InformationStructural formula
Name (2R,3R)-3,5,7,3',5'-Pentahydroxyflavanone 3-rhamnoside
Formula C21H22O11
Mw 450.11621155
CAS RN 677274-17-8
C_ID C00014413 ,
InChIKey HBHVCPGEAYWNOG-ZREKOUTKNA-N
InChICode InChI=1S/C21H22O11/c1-7-15(26)17(28)18(29)21(30-7)32-20-16(27)14-12(25)5-11(24)6-13(14)31-19(20)8-2-9(22)4-10(23)3-8/h2-7,15,17-26,28-29H,1H3/t7-,15-,17+,18-,19+,20+,21-/m0/s1
SMILES c1(cc2c(c(c1)O)C(=O)[C@H]([C@H](O2)c1cc(cc(c1)O)O)O[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeExcoecaria agallocha Ref.
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OrganismExcoecaria agallocha
ReferenceKonishi,Chem.Pharm. Bull.,51,(2003),1142