input word = C00000549

Metabolite InformationStructural formula
Name (+)-Geodin
Estin
Formula C17H12Cl2O7
Mw 397.99600816
CAS RN 427-63-4
C_ID C00000549 ,
InChIKey LUBKKVGXMXTXOZ-UHFFFAOYNA-N
InChICode InChI=1S/C17H12Cl2O7/c1-6-11(18)13(21)10-14(12(6)19)26-17(15(10)22)8(16(23)25-3)4-7(20)5-9(17)24-2/h4-5,21H,1-3H3/t17-/m1/s1
SMILES C1(=O)C=C([C@]2(C(=C1)OC)Oc1c(C2=O)c(c(c(c1Cl)C)Cl)O)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus terreus IMI16043 Ref.
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OrganismAspergillus terreus IMI16043
ReferenceBarton,Comprehensive natural products chemistry,Elsevier,vol1,(1999),1.16