input word = C00035747

Metabolite InformationStructural formula
Name Sphaeropsidin D
Formula C20H26O6
Mw 362.17293856
CAS RN 443129-18-8
C_ID C00035747 ,
InChIKey RGMZNUAVQHIGNL-PPWYMLDJNA-N
InChICode InChI=1S/C20H26O6/c1-5-17(4)9-11-13(22)20(25)14-16(2,3)7-6-8-18(14,15(23)26-20)19(11,24)12(21)10-17/h5,9,12,14,21,24-25H,1,6-8,10H2,2-4H3/t12-,14+,17-,18+,19+,20-/m1/s1
SMILES C1[C@](C=C2[C@]([C@@H]1O)([C@]13[C@@H]([C@](C2=O)(O)OC3=O)C(CCC1)(C)C)O)(C)C=C
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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