input word = C00042552

Metabolite InformationStructural formula
Name Gelomulide I
Formula C20H28O6
Mw 364.18858863
CAS RN 219915-75-0
C_ID C00042552 ,
InChIKey HIJNWAUJRBKZHT-SSGGFDNTNA-N
InChICode InChI=1S/C20H28O6/c1-9-15-10(26-17(9)24)7-12-19(4)11(5-6-20(12,25)16(15)23)18(2,3)13(21)8-14(19)22/h10-13,16,21,23,25H,5-8H2,1-4H3/t10-,11-,12+,13+,16+,19-,20+/m1/s1
SMILES CC1=C2[C@@H](C[C@@H]3[C@@](O)(CC[C@@H]4C(C)(C)[C@@H](O)CC(=O)[C@]43C)[C@H]2O)OC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeGelonium multiflorum A. Ref.
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