input word = C00058690

Metabolite InformationStructural formula
Name Plicatoside A
Formula C22H34O14
Mw 522.1948558
CAS RN 156031-81-1
C_ID C00058690
InChIKey NSCNDGKLVMYJPT-UHFFFAOYSA-N
InChICode InChI=1S/C22H34O14/c1-22(31)3-2-9-8(4-23)7-32-19(12(9)22)36-21-18(16(29)14(27)11(6-25)34-21)35-20-17(30)15(28)13(26)10(5-24)33-20/h4,7,9-21,24-31H,2-3,5-6H2,1H3
SMILES CC1(O)CCC2C(C=O)=COC(OC3OC(CO)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3O)C21
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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OrganismPedicularis striata
ReferenceZ. J. Jia et al., (1994), 121, 53971

Z. J. Jia et al., Chem. Abs., (1993), 121, 53882.