input word = C00031028

Metabolite InformationStructural formula
Name Picroside I
Formula C24H28O11
Mw 492.16316174
CAS RN 27409-30-9
C_ID C00031028 ,
InChIKey XZGPUOQGERGURE-OCAHRNEWNA-N
InChICode InChI=1S/C24H28O11/c25-11-24-16-13(17(27)21(24)35-24)8-9-31-22(16)34-23-20(30)19(29)18(28)14(33-23)10-32-15(26)7-6-12-4-2-1-3-5-12/h1-9,13-14,16-23,25,27-30H,10-11H2/b7-6+/t13-,14+,16+,17-,18+,19-,20+,21-,22-,23-,24+/m0/s1
SMILES [C@H]1([C@H]([C@@H]([C@H]([C@@H](O1)O[C@H]1[C@H]2[C@H](C=CO1)[C@@H]([C@H]1[C@]2(CO)O1)O)O)O)O)COC(=O)/C=C/c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlantaginaceaeNeopicrorhiza scrophulariiflora Ref.
PlantaePlantaginaceaePicrorhiza kurroa Ref.
PlantaePlantaginaceaePicrorhiza kurrooa Ref.
PlantaePlantaginaceaePicrorhiza scrophulariiflora Ref.
PlantaePlantaginaceaeWulfenia baldaccii Degen Ref.
PlantaePlantaginaceaeWulfenia blechicii Lakusic subsp. Ref.
--Picrorrhiza kurrooa Ref.
--Picrorrhiza scrophulariflora Ref.
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OrganismPicrorhiza kurroa
ReferenceJia,J.Nat.Prod.,62,(1999),901