input word = C00012293

Metabolite InformationStructural formula
Name Longicornin D
Formula C25H34O9
Mw 478.22028269
CAS RN 89900-54-9
C_ID C00012293 ,
InChIKey ZAWIKRVIJVSVPK-XAXODXSJNA-N
InChICode InChI=1S/C25H34O9/c1-7-14(4)23(28)33-20-17(25(30)31-6)10-8-9-16(12-26)11-18-19(15(5)24(29)32-18)21(20)34-22(27)13(2)3/h10-11,13-14,18-21,26H,5,7-9,12H2,1-4,6H3/b16-11-,17-10+/t14-,18+,19+,20+,21+/m0/s1
SMILES C=C1C(=O)OC2/C=C(CO)CC/C=C(/C(=O)OC)C(OC(=O)C(C)CC)C(OC(=O)C(C)C)C12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMelampodium longicorne Ref.
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OrganismMelampodium longicorne
ReferenceMalcolm,Phytochem.,22,(1983),2759