input word = C00016179

Metabolite InformationStructural formula
Name Herquline B
Formula C19H26N2O2
Mw 314.19942809
CAS RN 174423-44-0
C_ID C00016179 ,
InChIKey IKEHAWAEPHQJSM-JZMZTWCUNA-N
InChICode InChI=1S/C19H26N2O2/c1-21-11-14-6-12-2-4-18(22)16(8-12)17-9-13(3-5-19(17)23)7-15(21)10-20-14/h8-9,14-17,20H,2-7,10-11H2,1H3/t14-,15-,16+,17-/m0/s1
SMILES CN1C[C@@H]2CC3=C[C@H](C(=O)CC3)[C@H]3C=C(CCC3=O)C[C@H]1CN2
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg L-Asp
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium herquei Fg-372 Ref.
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