input word = C00006627

Metabolite InformationStructural formula
Name Pelargonidin 3-arabinoside
Formula C20H19O9
Mw 403.10290721
CAS RN 33569-08-3
C_ID C00006627 ,
InChIKey LEJPLPFWLUXHCB-CXVATLBVNA-O
InChICode InChI=1S/C20H18O9/c21-10-3-1-9(2-4-10)19-16(29-20-18(26)17(25)14(24)8-27-20)7-12-13(23)5-11(22)6-15(12)28-19/h1-7,14,17-18,20,24-26H,8H2,(H2-,21,22,23)/p+1/t14-,17+,18+,20+/m0/s1
SMILES c1(cc(c2c(c1)[o+]c(c(c2)O[C@@H]1[C@@H]([C@@H]([C@H](CO1)O)O)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEricaceaeAcrotriche serrulata Ref.
PlantaeEricaceaeCyathodes petiolaris Ref.
PlantaeEricaceaeEpacris impressa Ref.
PlantaeEricaceaeErica regia Ref.
PlantaeEricaceaeVaccinium japonicum Ref.
PlantaeMalvaceaeSterculia parviflora Ref.
PlantaePlantaginaceaePenstemon spp. Ref.
zoom in