input word = C00012150

Metabolite InformationStructural formula
Name Melfusin
Formula C23H26O11
Mw 478.14751167
CAS RN 78432-79-8
C_ID C00012150 ,
InChIKey BZBNXWIJKLZMQX-GGYSIASPNA-N
InChICode InChI=1S/C23H26O11/c1-10-14-16(32-21(28)22(4)11(2)33-22)15(25)13(20(27)29-5)7-6-8-23(9-30-12(3)24)18(34-23)17(14)31-19(10)26/h6-8,11,14-18,25H,1,9H2,2-5H3/b8-6-,13-7-/t11-,14-,15-,16+,17+,18+,22-,23+/m1/s1
SMILES C=C1C(=O)O[C@H]2[C@H]1[C@H](OC(=O)C1(C)OC1C)C(O)/C(C(=O)OC)=C/C=C[C@@]1(COC(C)=O)O[C@@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMelampodium diffusum Ref.
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