input word = C00014305

Metabolite InformationStructural formula
Name Pinocembrin 7-apiosyl-(1->5)-apiosyl-(1->2)-glucoside
5,7-Dihydroxyflavanone 7-apiosyl-(1->5)-apiosyl-(1->2)-glucoside
Formula C31H38O17
Mw 682.21089979
CAS RN 433979-36-3
C_ID C00014305 ,
InChIKey OGHKMYABKJLKTL-IRTSWMLXNA-N
InChICode InChI=1S/C31H38O17/c32-9-20-22(36)23(37)24(48-29-26(39)31(41,13-44-29)12-43-28-25(38)30(40,10-33)11-42-28)27(47-20)45-15-6-16(34)21-17(35)8-18(46-19(21)7-15)14-4-2-1-3-5-14/h1-7,18,20,22-29,32-34,36-41H,8-13H2/t18-,20+,22-,23+,24-,25-,26-,27-,28+,29+,30-,31+/m1/s1
SMILES O=C1CC(c2ccccc2)Oc2cc(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O[C@@H]3OCC(O)(CO[C@@H]4OCC(O)(CO)[C@@H]4O)[C@@H]3O)cc(O)c21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSantalaceaeViscum angulatum Ref.
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