input word = C00032108

Metabolite InformationStructural formula
Name Paeonin B
(+)-Paeonin B
Formula C23H28O11
Mw 480.16316174
CAS RN 618911-64-1
C_ID C00032108 ,
InChIKey YKRGDOXKVOZESV-QPFUNSOWNA-N
InChICode InChI=1S/C23H28O11/c1-20-9-22(29)13-7-23(20,32-18-16(27)15(26)14(25)12(8-24)31-18)21(13,19(33-20)34-22)10-30-17(28)11-5-3-2-4-6-11/h2-6,12-16,18-19,24-27,29H,7-10H2,1H3/t12-,13-,14+,15+,16-,18+,19-,20+,21+,22-,23+/m1/s1
SMILES C[C@@]12C[C@@]3(O)O[C@H](O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@@]12O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePaeoniaceaePaeonia emodi Ref.
PlantaePaeoniaceaePaeonia lactiflora Ref.
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