input word = C00010766

Metabolite InformationStructural formula
Name Jasminoside
Formula C26H30O13
Mw 550.16864105
CAS RN 82451-18-1
C_ID C00010766 ,
InChIKey JGHUOJAZXGSFRI-UXBOLSOONA-N
InChICode InChI=1S/C26H30O13/c1-35-20(29)11-16-15(9-10-36-19(28)8-7-14-5-3-2-4-6-14)25(37-13-17(16)24(33)34)39-26-23(32)22(31)21(30)18(12-27)38-26/h2-9,13,16,18,21-23,25-27,30-32H,10-12H2,1H3,(H,33,34)/b8-7+,15-9+/t16-,18+,21+,22-,23-,25-,26-/m0/s1
SMILES COC(=O)C[C@@H]1C(C(=O)O)=CO[C@@H](O[C@@H]2OC(CO)[C@@H](O)C(O)[C@@H]2O)/C1=C/COC(=O)/C=C/c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeJasminum humile Ref.
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