input word = C00034379

Metabolite InformationStructural formula
Name 2''-Epifraxamoside
Formula C25H30O13
Mw 538.16864105
CAS RN 946569-82-0
C_ID C00034379 ,
InChIKey QVUZRUJONIJRDT-ZDYSYVDPNA-N
InChICode InChI=1S/C25H30O13/c1-3-12-13-7-19(28)35-9-17(11-4-5-15(26)16(27)6-11)34-10-18-20(29)21(30)22(31)25(37-18)38-24(12)36-8-14(13)23(32)33-2/h3-6,8,13,17-18,20-22,24-27,29-31H,7,9-10H2,1-2H3/b12-3+/t13-,17+,18-,20+,21-,22+,24-,25-/m0/s1
SMILES C/C=C1/[C@H]2OC=C(C(=O)OC)[C@H]1CC(=O)OC[C@H](c1ccc(O)c(O)c1)OCC1O[C@@H](O2)[C@H](O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeJasminum grandiflorum Ref.
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