input word = C00006749

Metabolite InformationStructural formula
Name Europinidin 3-glucoside
Formula C23H25O12
Mw 493.13460127
CAS RN
C_ID C00006749 ,
InChIKey IMXDUPARSULLGK-RVBSYNOMNA-O
InChICode InChI=1S/C23H24O12/c1-31-13-5-10(25)6-14-11(13)7-16(34-23-21(30)20(29)19(28)17(8-24)35-23)22(33-14)9-3-12(26)18(27)15(4-9)32-2/h3-7,17,19-21,23-24,28-30H,8H2,1-2H3,(H2-,25,26,27)/p+1/t17-,19-,20+,21-,23-/m1/s1
SMILES COc1cc(-c2[o+]c3cc(O)cc(OC)c3cc2O[C@@H]2OC(CO)[C@@H](O)C(O)C2O)cc(O)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlumbaginaceaeCeratostigma plumbaginoides Ref.
PlantaePlumbaginaceaePlumbago europaea Ref.
zoom in