input word = C00012274

Metabolite InformationStructural formula
Name Linearilobin D
Formula C21H26O7
Mw 390.16785319
CAS RN 75683-58-8
C_ID C00012274 ,
InChIKey YKWSETWTGSXECN-LSFFGLKLNA-N
InChICode InChI=1S/C21H26O7/c1-12(2)20(24)27-17-8-15(10-22)6-5-7-16(11-26-14(4)23)9-18-19(17)13(3)21(25)28-18/h6,9,17-19,22H,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]2OC(=O)C(=C)C)\CO)/COC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMelampodium linearilobum Ref.
zoom in