input word = C00056690

Metabolite InformationStructural formula
Name Matenoside B
Formula C21H34O8
Mw 414.22536806
CAS RN 1232679-70-7
C_ID C00056690
InChIKey ACFLLXXBYKCGOS-UOGKLMMRSA-N
InChICode InChI=1S/C21H34O8/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/h8,12,15-20,24-26H,6-7,9-10H2,1-5H3/t12-,15-,16+,17+,18-,19+,20+/m0/s1
SMILES CC(=O)OC[C@H]1O[C@@H](O[C@@H](C)CC[C@H]2C(C)=CC(=O)CC2(C)C)[C@H](O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAquifoliaceaeIlex paraguariensis Ref.
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