input word = C00036701

Metabolite InformationStructural formula
Name (-)-Alatoside A
Alatoside A(Laggera alata)
Formula C21H36O8
Mw 416.24101813
CAS RN 610787-87-6
C_ID C00036701 ,
InChIKey IVKBSSLXVCZRDK-FMEXRQNJNA-N
InChICode InChI=1S/C21H36O8/c1-10(2)11-5-6-20(3)14(7-11)21(4,27)8-12(23)18(20)29-19-17(26)16(25)15(24)13(9-22)28-19/h11-19,22-27H,1,5-9H2,2-4H3/t11-,12+,13+,14+,15+,16-,17+,18-,19-,20+,21+/m0/s1
SMILES C=C(C)[C@H]1CC[C@]2(C)[C@@H](C1)[C@](C)(O)C[C@@H](O)[C@@H]2O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeLaggera alata Ref.
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