input word = C00014344

Metabolite InformationStructural formula
Name Alhagidin
5,7,3'-Trihydroxy-4'-methoxyflavanone 7-galactosyl-(1->2)-[rhamnosyl-(1->6)]glucoside
Formula C34H44O20
Mw 772.24259385
CAS RN 238750-98-6
C_ID C00014344 ,
InChIKey RYTOQEJVKIKIBZ-WMRGHSDJNA-N
InChICode InChI=1S/C34H44O20/c1-11-23(39)26(42)29(45)32(49-11)48-10-21-25(41)28(44)31(54-33-30(46)27(43)24(40)20(9-35)52-33)34(53-21)50-13-6-15(37)22-16(38)8-18(51-19(22)7-13)12-3-4-17(47-2)14(36)5-12/h3-7,11,18,20-21,23-37,39-46H,8-10H2,1-2H3/t11-,18-,20-,21+,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34+/m0/s1
SMILES c1(cc2c(c(c1)O)C(=O)C[C@H](O2)c1cc(c(cc1)OC)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)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
PlantaeFabaceaeAlhagi pseudalhagi Ref.
PlantaeFabaceaeAlhagi pseudoalhagi Ref.
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