input word = C00014845

Metabolite InformationStructural formula
Name 6-Hydroxypelargonidin 3-glucoside
Formula C21H21O11
Mw 449.10838652
CAS RN 554450-51-0
C_ID C00014845 ,
InChIKey XLFIHBGWQPLWMM-SLOFXGIQNA-O
InChICode InChI=1S/C21H20O11/c22-7-14-17(27)18(28)19(29)21(32-14)31-13-5-10-12(6-11(24)16(26)15(10)25)30-20(13)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1/t14-,17-,18+,19-,21-/m1/s1
SMILES c1(c(c(c2c(c1)[o+]c(c(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)c1ccc(cc1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAlstroemeriaceaeAlstroemeria spp. Ref.
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