input word = C00014406

Metabolite InformationStructural formula
Name (2R,3R)-3,5,7,4'-Tetrahydroxyflavanone 7-(6-[4-Hydroxy-2-methylenebutanoyl]glucoside)
Formula C26H28O13
Mw 548.15299098
CAS RN 348087-79-6
C_ID C00014406 ,
InChIKey VHLPHZHKMCRDIB-YIPRNBEHNA-N
InChICode InChI=1S/C26H28O13/c1-11(6-7-27)25(35)36-10-17-19(30)21(32)23(34)26(39-17)37-14-8-15(29)18-16(9-14)38-24(22(33)20(18)31)12-2-4-13(28)5-3-12/h2-5,8-9,17,19,21-24,26-30,32-34H,1,6-7,10H2/t17-,19-,21+,22-,23-,24+,26-/m1/s1
SMILES c1(cc2c(c(c1)O)C(=O)[C@H]([C@@H](O2)c1ccc(cc1)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C(=C)CCO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAfzelia bella Ref.
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