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@@]12([C@@H]([C@H](C[C@@]3([C@H]([C@H]1OC(=O)C)O3)C)OC(=O)/C(=C\C)/C)[C@@](C[C@@H]2OC(=O)C)(C(C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula lapidosa Ref.
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