input word = C00031052

Metabolite InformationStructural formula
Name Plantainoside D
(+)-Plantainoside D
Formula C29H36O16
Mw 640.20033511
CAS RN 147331-98-4
C_ID C00031052 ,
InChIKey CBZYUWGJNYOKHT-ZZXKWVIFNA-N
InChICode InChI=1S/C29H36O16/c30-11-19-22(36)24(38)25(39)29(43-19)45-27-23(37)20(12-42-21(35)6-3-13-1-4-15(31)17(33)9-13)44-28(26(27)40)41-8-7-14-2-5-16(32)18(34)10-14/h1-6,9-10,19-20,22-34,36-40H,7-8,11-12H2/b6-3+/t19-,20-,22+,23-,24+,25-,26-,27-,28-,29+/m0/s1
SMILES [C@@H]1([C@H]([C@H]([C@@H](O[C@@H]1OCCc1ccc(c(c1)O)O)COC(=O)/C=C/c1ccc(c(c1)O)O)O)O[C@H]1O[C@H]([C@H]([C@H]([C@@H]1O)O)O)CO)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlantaginaceaePicrorhiza scrophulariiflora Ref.
PlantaePlantaginaceaePlantago asiatica Ref.
PlantaePlantaginaceaePlantago hostifolia Ref.
PlantaePlantaginaceaePlantago lanceolata Ref.
--Hemiphragma heterophyllum Ref.
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