input word = C00011759

Metabolite InformationStructural formula
Name Lactuside B
Formula C21H32O9
Mw 428.20463262
CAS RN 106009-42-1
C_ID C00011759 ,
InChIKey YPUAPUZIURIYPB-WBPUIMTGNA-N
InChICode InChI=1S/C21H32O9/c1-10-7-15-13(11(2)20(27)28-15)5-3-12(8-22)4-6-14(10)29-21-19(26)18(25)17(24)16(9-23)30-21/h4,7,11,13-19,21-26H,3,5-6,8-9H2,1-2H3/b10-7+,12-4+/t11-,13-,14-,15-,16+,17+,18-,19+,21+/m0/s1
SMILES C/C1=C[C@H]2OC(=O)[C@@H](C)[C@@H]2CC/C(CO)=CC[C@@H]1O[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeLactuca lacianata Ref.
PlantaeAsteraceaeLactuca laciniata Ref.
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