input word = C00027550

Metabolite InformationStructural formula
Name Isoalangiside
Formula C25H31NO10
Mw 505.19479622
CAS RN 57128-91-3
C_ID C00027550 ,
InChIKey BCYNGTTVQNJTCV-ZEERKBMGNA-N
InChICode InChI=1S/C25H31NO10/c1-3-12-14-7-16-13-8-17(28)18(33-2)6-11(13)4-5-26(16)23(32)15(14)10-34-24(12)36-25-22(31)21(30)20(29)19(9-27)35-25/h3,6,8,10,12,14,16,19-22,24-25,27-31H,1,4-5,7,9H2,2H3/t12-,14-,16-,19+,20+,21-,22+,24-,25-/m0/s1
SMILES [C@H]1(OC=C2[C@H]([C@@H]1C=C)C[C@@H]1N(C2=O)CCc2c1cc(c(c2)OC)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCornaceae/Aucubaceae/Garryaceae/HelwingiaceaeAlangium lamarckii Ref.
PlantaeCornaceae/Aucubaceae/Garryaceae/HelwingiaceaeAlangium salviifolium Ref.
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