input word = C00036396

Metabolite InformationStructural formula
Name 10-Acetylaucubin
Formula C17H24O10
Mw 388.13694699
CAS RN 134140-01-5
C_ID C00036396 ,
InChIKey NTXYRYAVOMIMPH-VFVKIASDNA-N
InChICode InChI=1S/C17H24O10/c1-7(19)25-6-8-4-10(20)9-2-3-24-16(12(8)9)27-17-15(23)14(22)13(21)11(5-18)26-17/h2-4,9-18,20-23H,5-6H2,1H3/t9-,10+,11-,12-,13-,14+,15-,16+,17+/m1/s1
SMILES CC(=O)OCC1=C[C@@H](O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12
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.
PlantaePlantaginaceaePlantago subulata Ref.
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OrganismPedicularis alaschanica
ReferenceJ. Gao et al., Chem. Abs., (1993), 119, 135638.