input word = C00034962

Metabolite InformationStructural formula
Name Tropolactone A
Formula C26H34O7
Mw 458.23045344
CAS RN 913079-19-3
C_ID C00034962 ,
InChIKey WNUMYPZZQQLDBA-NVEUQTAGNA-N
InChICode InChI=1S/C26H34O7/c1-13-10-15-11-17-25(5,33-22(15)14(2)21(29)20(13)23(30)31-7)9-8-16-24(3,4)32-19(28)12-18(27)26(16,17)6/h10,16-18,27H,8-9,11-12H2,1-7H3/t16-,17+,18+,25-,26-/m0/s1
SMILES c1(c(c(=O)c(c2c(c1)C[C@@H]1[C@@](O2)(CC[C@@H]2[C@@]1([C@@H](CC(=O)OC2(C)C)O)C)C)C)C(=O)OC)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus sp. CNK-371 Ref.
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OrganismAspergillus sp. CNK-371
ReferenceCueto,Phytochem.,67,(2006),1826