input word = C00038964

Metabolite InformationStructural formula
Name Delphinidin 3-O-glucoside
Formula C21H21O12
Mw 465.10330114
CAS RN 50986-17-9
C_ID C00038964 ,
InChIKey OIZFQAFWYYKPMR-XERONKFZNA-N
InChICode InChI=1S/C21H21O12/c22-6-15-17(28)18(29)19(30)21(33-15)32-14-5-9-10(24)3-8(23)4-13(9)31-20(14)7-1-11(25)16(27)12(26)2-7/h1-5,15,17-19,21-30H,6H2/t15-,17-,18+,19-,21-/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)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEricaceaeVaccinium arboreum Marsh. Ref.
PlantaeEricaceaeVaccinium padifolium Ref.
PlantaeFabaceaePhaseolus vulgaris Ref.
PlantaeLythraceaePunica granatum Ref.
PlantaeRutaceaeCitrus sinensis Ref.
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OrganismPhaseolus vulgaris
Referencehttps://doi.org/10.4236/fns.2012.33050