input word = C00027578

Metabolite InformationStructural formula
Name O-Methylisoalangiside
Formula C26H33NO10
Mw 519.21044628
CAS RN 57128-92-4
C_ID C00027578 ,
InChIKey KZHPALDKTHCPDG-HWBMBMSBNA-N
InChICode InChI=1S/C26H33NO10/c1-4-13-15-8-17-14-9-19(34-3)18(33-2)7-12(14)5-6-27(17)24(32)16(15)11-35-25(13)37-26-23(31)22(30)21(29)20(10-28)36-26/h4,7,9,11,13,15,17,20-23,25-26,28-31H,1,5-6,8,10H2,2-3H3/t13-,15-,17-,20+,21+,22-,23+,25-,26-/m0/s1
SMILES [C@H]1(OC=C2[C@H]([C@@H]1C=C)C[C@@H]1N(C2=O)CCc2c1cc(c(c2)OC)OC)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
PlantaeCornaceae/Aucubaceae/Garryaceae/HelwingiaceaeAlangium lamarckii Ref.
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OrganismAlangium lamarckii
ReferenceItoh,J.Nat.Prod.,58,(1995),1228

Itoh,Phytochem.,41,(1996),651