input word = C00011761

Metabolite InformationStructural formula
Name Lactuside A
Formula C21H30O9
Mw 426.18898256
CAS RN 106009-43-2
C_ID C00011761 ,
InChIKey TZXUUTQEICXCOH-WBPUIMTGNA-N
InChICode InChI=1S/C21H30O9/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/h4,7-8,11,13-19,21,23-26H,3,5-6,9H2,1-2H3/b10-7+,12-4+/t11-,13-,14-,15-,16+,17+,18-,19+,21+/m0/s1
SMILES [C@@H]12[C@@H](OC(=O)[C@H]1C)/C=C(/[C@@H](O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C/C=C(\CC2)/C=O)\C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeLactuca lacianata Ref.
PlantaeAsteraceaeLactuca laciniata Ref.
PlantaeAsteraceaeLactuca perennis L. Ref.
PlantaeAsteraceaeLactuca quercina L. Ref.
PlantaeAsteraceaeLactuca saligna L. Ref.
PlantaeAsteraceaeLactuca serriola L. Ref.
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OrganismLactuca quercina L.
ReferenceZidorn,Phytochem.,69,(2008),2270