input word = C00021390

Metabolite InformationStructural formula
Name Ferutin
Formula C23H32O5
Mw 388.22497413
CAS RN 41744-35-8
C_ID C00021390 ,
InChIKey BEKZGSZBVDHRTH-QLGQXQMYNA-N
InChICode InChI=1S/C23H32O5/c1-14(2)23(26)11-10-22(4)9-8-15(3)12-19(20(22)23)28-21(25)16-6-7-18(27-5)17(24)13-16/h6-8,13-14,19-20,24,26H,9-12H2,1-5H3/t19-,20+,22-,23+/m0/s1
SMILES COc1ccc(C(=O)O[C@H]2CC(C)=CC[C@@]3(C)CC[C@@](O)(C(C)C)[C@H]23)cc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula spp. Ref.
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