input word = C00042550

Metabolite InformationStructural formula
Name Gelomulide F
(+)-Gelomulide F
Formula C22H28O6
Mw 388.18858863
CAS RN 122537-64-8
C_ID C00042550 ,
InChIKey LFDBTGJYHYPDTA-SAZOTJLRNA-N
InChICode InChI=1S/C22H28O6/c1-10-17-12(27-19(10)25)8-14-21(5)13(6-7-22(14)18(17)28-22)20(3,4)15(24)9-16(21)26-11(2)23/h12-14,16,18H,6-9H2,1-5H3/t12-,13-,14+,16-,18-,21-,22+/m1/s1
SMILES CC(=O)O[C@@H]1CC(=O)C(C)(C)[C@H]2CC[C@@]34O[C@@H]3C3=C(C)C(=O)O[C@@H]3C[C@H]4[C@@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeGelonium multiflorum A. Ref.
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