input word = C00007891

Metabolite InformationStructural formula
Name 2',4',6',beta-Tetrahydroxychalcone 4'-glucoside
Formula C21H22O10
Mw 434.12129692
CAS RN 50634-04-3
C_ID C00007891 ,
InChIKey HAVNCBAQNUDYRJ-OHPGNTIMNA-N
InChICode InChI=1S/C21H22O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-11-6-13(24)17(14(25)7-11)15(26)8-12(23)10-4-2-1-3-5-10/h1-7,16,18-22,24-25,27-29H,8-9H2/t16-,18+,19-,20+,21+/m0/s1
SMILES c1(cc(c(c(c1)O)C(=O)CC(=O)c1ccccc1)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaeMalus sp. Ref.
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