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 c1(cc(c2c(c1)[o+]c(c(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)c1cc(c(c(c1)OC)O)O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlumbaginaceaeCeratostigma plumbaginoides Ref.
PlantaePlumbaginaceaePlumbago europaea Ref.
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