input word = C00035748

Metabolite InformationStructural formula
Name Sphaeropsidin E
Formula C20H32O3
Mw 320.23514489
CAS RN 443129-20-2
C_ID C00035748 ,
InChIKey PEVPTRLNHNJRMF-UVZCEFGTNA-N
InChICode InChI=1S/C20H32O3/c1-6-19(4)11-13(22)16-15(17(19)23)12(21)10-14-18(2,3)8-7-9-20(14,16)5/h6,12-14,17,21-23H,1,7-11H2,2-5H3/t12-,13+,14+,17-,19+,20+/m1/s1
SMILES C=C[C@@]1(C)C[C@H](O)C2=C([C@H](O)C[C@H]3C(C)(C)CCC[C@]23C)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiBotryosphaeriaceaeDiplodia mutila (Fr.) Mont. Ref.
FungiIncertae sedisSphaeropsis sapinea f.sp.cupressi Ref.
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OrganismSphaeropsis sapinea f.sp.cupressi
ReferenceSparapano,Phytochem.,65,(2004),189