input word = C00031070

Metabolite InformationStructural formula
Name Poliumoside
Formula C35H46O19
Mw 770.26332929
CAS RN 94079-81-9
C_ID C00031070 ,
InChIKey YMWRMAOPKNYHMZ-VMPITWQZNA-N
InChICode InChI=1S/C35H46O19/c1-14-24(41)26(43)28(45)33(50-14)49-13-22-31(53-23(40)8-5-16-3-6-18(36)20(38)11-16)32(54-35-29(46)27(44)25(42)15(2)51-35)30(47)34(52-22)48-10-9-17-4-7-19(37)21(39)12-17/h3-8,11-12,14-15,22,24-39,41-47H,9-10,13H2,1-2H3/b8-5+/t14-,15-,22-,24+,25-,26-,27-,28+,29-,30-,31-,32-,33+,34-,35-/m0/s1
SMILES CC1OC(OCC2OC(OCCc3ccc(O)c(O)c3)C(O)C(OC3OC(C)C(O)C(O)C3O)C2OC(=O)/C=C/c2ccc(O)c(O)c2)C(O)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeBarleria lupulina Ref.
PlantaeLabiataeCallicarpa japonica Thunb.var.luxurians Rehd. Ref.
PlantaeOleaceaeJasminum nudiflorum Ref.
PlantaeOleaceaeSyringa afghanica Ref.
PlantaePlantaginaceaeErinus alpinus Ref.
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