input word = C00011740

Metabolite InformationStructural formula
Name Lacinolide B
Formula C20H27ClO7
Mw 414.14453093
CAS RN 124878-04-2
C_ID C00011740 ,
InChIKey WEVOOBRFSCEKNH-CESNYVJGNA-N
InChICode InChI=1S/C20H27ClO7/c1-9-6-13-16(10(2)17(23)26-13)14(27-18(24)20(5,25)11(3)22)8-19(4)15(28-19)7-12(9)21/h6,11-16,22,25H,2,7-8H2,1,3-5H3/b9-6-/t11-,12-,13+,14+,15+,16-,19-,20+/m0/s1
SMILES C1[C@@H](/C(=C\[C@@H]2[C@@H]([C@@H](C[C@]3([C@@H]1O3)C)OC(=O)[C@]([C@H](C)O)(C)O)C(=C)C(=O)O2)/C)Cl
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeViguiera laciniata Ref.
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OrganismViguiera laciniata
ReferenceGao,Phytochem.,29,(1989),2409