input word = C00021414

Metabolite InformationStructural formula
Name Lapidolin
Formula C24H36O8
Mw 452.24101813
CAS RN 85179-08-4
C_ID C00021414 ,
InChIKey YYDGJPCYIUPVBW-TUEDWBJENA-N
InChICode InChI=1S/C24H36O8/c1-9-13(4)21(27)31-16-10-22(7)19(32-22)20(30-15(6)26)23(8)17(29-14(5)25)11-24(28,12(2)3)18(16)23/h9,12,16-20,28H,10-11H2,1-8H3/b13-9-/t16-,17-,18+,19-,20+,22+,23-,24+/m0/s1
SMILES C/C=C(/C)C(=O)O[C@H]1C[C@@]2(C)O[C@H]2[C@@H](OC(C)=O)[C@@]2(C)[C@@H](OC(C)=O)C[C@@](O)(C(C)C)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula lapidosa Ref.
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