input word = C00033281

Metabolite InformationStructural formula
Name Oxypaeoniflorin
Formula C23H28O12
Mw 496.15807636
CAS RN 39011-91-1
C_ID C00033281 ,
InChIKey FCHVXNVDFYXLIL-BYJQOQJSNA-N
InChICode InChI=1S/C23H28O12/c1-20-8-22(30)13-6-23(20,33-18-16(28)15(27)14(26)12(7-24)32-18)21(13,19(34-20)35-22)9-31-17(29)10-2-4-11(25)5-3-10/h2-5,12-16,18-19,24-28,30H,6-9H2,1H3/t12-,13-,14-,15+,16-,18+,19-,20+,21+,22-,23+/m1/s1
SMILES [C@@]12(COC(=O)c3ccc(cc3)O)[C@@]3(O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)[C@]4(O[C@@H]1O[C@@]([C@@H]2C3)(C4)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePaeoniaceaePaeonia albiflora Ref.
PlantaePaeoniaceaePaeonia lactiflora wild Ref.
PlantaePaeoniaceaePaeonia moutan Ref.
PlantaePaeoniaceaePaeonia obovata Ref.
PlantaePaeoniaceaePaeonia suffruticosa ANDREWS Ref.
PlantaePaeoniaceaePaeonia veitchii Ref.
PlantaeRutaceaePhellodendron amurense Ref.
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