input word = C00058387

Metabolite InformationStructural formula
Name Boschnaloside
Formula C16H24O8
Mw 344.14711774
CAS RN 72963-55-4
C_ID C00058387
InChIKey MRIFZKMKTDPBHR-XLOWEYQUSA-N
InChICode InChI=1S/C16H24O8/c1-7-2-3-9-8(4-17)6-22-15(11(7)9)24-16-14(21)13(20)12(19)10(5-18)23-16/h4,6-7,9-16,18-21H,2-3,5H2,1H3/t7-,9-,10-,11-,12-,13+,14-,15+,16+/m1/s1
SMILES C[C@@H]1CC[C@@H]2C(C=O)=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 longiflora var. tubiformis Ref.
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OrganismPedicularis longiflora var. tubiformis
ReferenceM. Fujii et al., Chem. Abs., (1995), 124, 112463.