input word = C00033860

Metabolite InformationStructural formula
Name Gelomulide K
(-)-Gelomulide K
Formula C22H28O5
Mw 372.193674
CAS RN 1005211-99-3
C_ID C00033860 ,
InChIKey IWHCUIYQYFOMEF-LGAGPGRTNA-N
InChICode InChI=1S/C22H28O5/c1-11-17-13(26-19(11)24)10-15-21(5)14(6-9-22(15)18(17)27-22)20(3,4)8-7-16(21)25-12(2)23/h7-8,13-16,18H,6,9-10H2,1-5H3/t13-,14-,15+,16-,18-,21-,22+/m1/s1
SMILES [C@H]12C(=C(C(=O)O2)C)[C@@H]2[C@]3([C@@H](C1)[C@]1([C@H](CC3)C(C=C[C@H]1OC(=O)C)(C)C)C)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeGelonium aequoreum Ref.
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OrganismGelonium aequoreum
ReferenceLee,Phytochem.,69,(2008),276