input word = C00012243

Metabolite InformationStructural formula
Name Cordifolia 31
Formula C19H22O8
Mw 378.13146768
CAS RN 91161-83-0
C_ID C00012243 ,
InChIKey MOBQCEOSHVWPAB-UHFFFAOYNA-N
InChICode InChI=1S/C19H22O8/c1-7(2)16(21)24-9-5-18(4)14(27-18)12-15(25-12)19(6-23-19)13(20)11-10(9)8(3)17(22)26-11/h9-15,20H,1,3,5-6H2,2,4H3/t9-,10-,11+,12+,13+,14+,15+,18+,19+/m0/s1
SMILES [C@@H]12OC(=O)C(=C)[C@H]1[C@H](C[C@@]1([C@@H]([C@@H]3[C@H]([C@@]4([C@@H]2O)OC4)O3)O1)C)OC(=O)C(=C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeErlangea cordifolia Ref.
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OrganismErlangea cordifolia
ReferenceRustaiyan,Phytochem.,19,(1980),1230

Begley,J.Chem.Soc.Perkin Trans,1,(1981),2702

Begley,J.Chem.Soc.Perkin Trans,1,(1984),819