input word = C00012275

Metabolite InformationStructural formula
Name Linearilobin E
Formula C21H26O7
Mw 390.16785319
CAS RN 75683-59-9
C_ID C00012275 ,
InChIKey QZSVNNCXCGAUDT-LSFFGLKLNA-N
InChICode InChI=1S/C21H26O7/c1-12(2)20(24)27-11-15-6-5-7-16(10-26-14(4)22)9-18-19(17(23)8-15)13(3)21(25)28-18/h6,9,17-19,23H,1,3,5,7-8,10-11H2,2,4H3/b15-6-,16-9-/t17-,18+,19-/m1/s1
SMILES [C@@H]12[C@@H](OC(=O)C1=C)/C=C(/CC/C=C(\C[C@H]2O)/COC(=O)C(=C)C)\COC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMelampodium linearilobum Ref.
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OrganismMelampodium linearilobum
ReferenceSeaman,Phytochem.,19,(1980),849