input word = C00006113

Metabolite InformationStructural formula
Name Palodulcin B
Formula C21H22O10
Mw 434.12129692
CAS RN
C_ID C00006113 ,
InChIKey LCNHZAAYBQWOCS-DOPQRMCMNA-N
InChICode InChI=1S/C21H22O10/c22-7-15-17(27)18(28)19(29)21(31-15)16-11(24)4-2-9-12(25)6-14(30-20(9)16)8-1-3-10(23)13(26)5-8/h1-5,14-15,17-19,21-24,26-29H,6-7H2/t14-,15+,17-,18-,19+,21-/m0/s1
SMILES c1(ccc2c(c1[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O[C@@H](CC2=O)c1ccc(c(c1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeEysenhardtia polystachya Ref.
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