input word = C00030676

Metabolite InformationStructural formula
Name Lisianthioside
Formula C32H44O18
Mw 716.25276461
CAS RN 131889-67-3
C_ID C00030676 ,
InChIKey RIPZUWHZZHFHAQ-FJHZLRBXNA-N
InChICode InChI=1S/C32H44O18/c1-3-13-15-5-7-43-28(42)18-12-46-30(50-32-26(40)24(38)22(36)20(10-34)48-32)14(4-2)16(18)6-8-44-27(41)17(15)11-45-29(13)49-31-25(39)23(37)21(35)19(9-33)47-31/h3-4,11-16,19-26,29-40H,1-2,5-10H2/t13-,14-,15-,16+,19-,20-,21-,22-,23+,24+,25-,26-,29+,30-,31+,32+/m1/s1
SMILES O1[C@@H]([C@@H]([C@H]2C(=C1)C(=O)OCC[C@H]1C(=CO[C@H]([C@@H]1C=C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)C(=O)OCC2)C=C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDipsacaceae/Diervillaceae/Linnaeaceae/ValerianaceaeDipsacus asper Ref.
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