input word = C00058691

Metabolite InformationStructural formula
Name Plicatoside B
Formula C22H34O14
Mw 522.1948558
CAS RN 156031-82-2
C_ID C00058691
InChIKey RKJHVRABXVBFKQ-UHFFFAOYSA-N
InChICode InChI=1S/C22H34O14/c1-22(30)4-3-8-9(18(29)31-2)6-32-19(12(8)22)36-21-16(28)14(26)17(11(5-23)34-21)35-20-15(27)13(25)10(24)7-33-20/h6,8,10-17,19-21,23-28,30H,3-5,7H2,1-2H3
SMILES COC(=O)C1=COC(OC2OC(CO)C(OC3OCC(O)C(O)C3O)C(O)C2O)C2C1CCC2(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrobanchaceaePedicularis alaschanica Ref.
PlantaeOrobanchaceaePedicularis chinensis Ref.
PlantaeOrobanchaceaePedicularis lasiophrys Ref.
PlantaeOrobanchaceaePedicularis longiflora Ref.
PlantaeOrobanchaceaePedicularis plicata Ref.
PlantaeOrobanchaceaePedicularis procera Ref.
PlantaeOrobanchaceaePedicularis semitorta Ref.
PlantaeOrobanchaceaePedicularis spicata Ref.
PlantaeOrobanchaceaePedicularis striata Ref.
PlantaeOrobanchaceaePedicularis striata pall ssp. arachnoidea Ref.
PlantaeOrobanchaceaePedicularis striata subsp. arachnoides Ref.
PlantaeOrobanchaceaePedicularis torta Ref.
PlantaeOrobanchaceaePedicularis verticillata Ref.
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