input word = C00012278

Metabolite InformationStructural formula
Name Linearilobin H
Formula C21H26O7
Mw 390.16785319
CAS RN 75683-56-6
C_ID C00012278 ,
InChIKey PCUTURVNWLKSCW-VZDOYBGXNA-N
InChICode InChI=1S/C21H26O7/c1-12(2)20(24)26-11-16-7-5-6-15(10-22)8-18-19(13(3)21(25)28-18)17(9-16)27-14(4)23/h7-8,17-19,22H,1,3,5-6,9-11H2,2,4H3/b15-8+,16-7-/t17-,18-,19+/m0/s1
SMILES [C@@H]12[C@@H](OC(=O)C1=C)/C=C(\CC/C=C(/C[C@@H]2OC(=O)C)\COC(=O)C(=C)C)/CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMelampodium linearilobum Ref.
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