input word = C00056689

Metabolite InformationStructural formula
Name Matenoside A
Formula C21H32O8
Mw 412.209718
CAS RN 1232679-68-3
C_ID C00056689
InChIKey ORTFVSDNENHVTL-PZNRNZDQSA-N
InChICode InChI=1S/C21H32O8/c1-11-8-14(23)9-21(4,5)15(11)7-6-12(2)28-20-19(26)18(25)17(24)16(29-20)10-27-13(3)22/h6-8,12,15-20,24-26H,9-10H2,1-5H3/b7-6+/t12-,15+,16-,17-,18+,19-,20-/m1/s1
SMILES O=C1CC(C)(C)[C@@H](/C=C/[C@@H](C)O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](COC(C)=O)O2)C(C)=C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAquifoliaceaeIlex paraguariensis Ref.
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