input word = C00034172

Metabolite InformationStructural formula
Name Preussomerin EG3
(-)-Preussomerin EG3
Formula C21H16O7
Mw 380.08960287
CAS RN 1015248-95-9
C_ID C00034172 ,
InChIKey TVCMYNVBJFGZDU-GAENOXONNA-N
InChICode InChI=1S/C21H16O7/c1-25-16-9-13(24)10-3-2-4-14-18(10)21(16)27-15-6-5-11(22)17-12(23)7-8-20(26-14,28-21)19(15)17/h2-6,16,22H,7-9H2,1H3/t16-,20-,21-/m1/s1
SMILES c12c3[C@@]4(Oc5c6[C@@](O1)(CCC(=O)c6c(cc5)O)O4)[C@@H](CC(=O)c3ccc2)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Edenia gomezpompae Ref.
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OrganismEdenia gomezpompae
ReferenceMacias-Rubalcava,Phytochem.,69,(2008),1185