input word = C00036875

Metabolite InformationStructural formula
Name Canthoside A
(-)-Canthoside A
Formula C19H26O12
Mw 446.1424263
CAS RN 491613-70-8
C_ID C00036875 ,
InChIKey ZOIVCDCWDFQVRB-JYHGODPUNA-N
InChICode InChI=1S/C19H26O12/c1-27-16(25)9-4-2-3-5-10(9)30-17-14(23)13(22)12(21)11(31-17)6-28-18-15(24)19(26,7-20)8-29-18/h2-5,11-15,17-18,20-24,26H,6-8H2,1H3/t11-,12-,13+,14-,15+,17-,18-,19-/m1/s1
SMILES COC(=O)c1ccccc1O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeCanthium berberidifolium Ref.
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