input word = C00057746

Metabolite InformationStructural formula
Name 2,4,6-Trihydroxy-3-[1-hydroxy-3-(4-hydroxyphenyl)-2-propenyl]phenyl beta-D-glucopyranoside
Formula C21H24O11
Mw 452.13186161
CAS RN 102716-32-5
C_ID C00057746
InChIKey YIJNZIXWHVONBS-HJGXYSLHSA-N
InChICode InChI=1S/C21H24O11/c22-8-14-16(27)18(29)19(30)21(31-14)32-20-13(26)7-12(25)15(17(20)28)11(24)6-3-9-1-4-10(23)5-2-9/h1-7,11,14,16,18-19,21-30H,8H2/b6-3+/t11?,14-,16-,18+,19-,21+/m1/s1
SMILES OC[C@H]1O[C@@H](Oc2c(O)cc(O)c(C(O)/C=C/c3ccc(O)cc3)c2O)[C@H](O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCarthamus tinctorius Ref.
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OrganismCarthamus tinctorius
ReferenceSaito, K. et al., Acta Soc. Bot. Pol., 1989, 58, 593