input word = C00010132

Metabolite InformationStructural formula
Name Iristectorigenin B 7-O-glucoside
Iristectorin B
Formula C23H24O12
Mw 492.12677623
CAS RN 94396-09-5
C_ID C00010132 ,
InChIKey XVNKSNSGLVWSFS-DITHNNADNA-N
InChICode InChI=1S/C23H24O12/c1-31-12-5-9(3-4-11(12)25)10-8-33-13-6-14(22(32-2)19(28)16(13)17(10)26)34-23-21(30)20(29)18(27)15(7-24)35-23/h3-6,8,15,18,20-21,23-25,27-30H,7H2,1-2H3/t15-,18+,20-,21+,23+/m0/s1
SMILES COc1cc(-c2coc3cc(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c(OC)c(O)c3c2=O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIridaceaeBelamcanda chinensis Ref.
PlantaeIridaceaeIris milesii Ref.
PlantaeIridaceaeIris tectorum Ref.
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