input word = C00010761

Metabolite InformationStructural formula
Name Isoligustroside
Formula C25H32O12
Mw 524.18937649
CAS RN 108789-18-0
C_ID C00010761 ,
InChIKey UFOVAZLPOLBVGA-AADWTEDDNA-N
InChICode InChI=1S/C25H32O12/c1-3-15-16(10-19(28)33-2)17(23(32)34-9-8-13-4-6-14(27)7-5-13)12-35-24(15)37-25-22(31)21(30)20(29)18(11-26)36-25/h3-7,12,16,18,20-22,24-27,29-31H,8-11H2,1-2H3/b15-3+/t16-,18+,20+,21-,22-,24-,25-/m0/s1
SMILES C/C=C1/[C@H](O[C@@H]2OC(CO)[C@@H](O)C(O)[C@@H]2O)OC=C(C(=O)OCCc2ccc(O)cc2)[C@H]1CC(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeSyringa afghanica Ref.
PlantaeOleaceaeSyringa vulgaris Ref.
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