input word = C00016973

Metabolite InformationStructural formula
Name Eremofortin E
Formula C17H21NO6
Mw 335.13688741
CAS RN 77732-43-5
C_ID C00016973 ,
InChIKey ASDRLEIRFUEAND-UHFFFAOYNA-N
InChICode InChI=1S/C17H21NO6/c1-7-11(22-8(2)19)13-12(23-13)9-5-10(20)17(6-15(7,9)3)16(4,24-17)14(18)21/h5,7,11-13H,6H2,1-4H3,(H2,18,21)/t7-,11-,12+,13-,15+,16-,17+/m0/s1
SMILES C1(=O)[C@]2(C[C@]3(C(=C1)[C@@H]1[C@H]([C@H]([C@@H]3C)OC(=O)C)O1)C)[C@](O2)(C)C(=O)N
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium roquefortii Ref.
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