input word = C00052188

Metabolite InformationStructural formula
Name Alantrypinene B
Formula C21H16N4O2
Mw 356.12732578
CAS RN 853245-38-2
C_ID C00052188
InChIKey UGJOAVUFFONAPW-TYCQWZJGSA-N
InChICode InChI=1S/C21H16N4O2/c1-20-19-23-14-8-4-2-6-12(14)18(27)25(19)16(17(26)24-20)10-21(20)11-22-15-9-5-3-7-13(15)21/h2-9,11,16H,10H2,1H3,(H,24,26)/t16-,20+,21-/m1/s1
SMILES C[C@@]12NC(=O)[C@@H](C[C@]13C=Nc1ccccc13)n1c2nc2ccccc2c1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeEupenicillium sp. Ref.
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OrganismEupenicillium sp.
ReferenceNatural Products Vol.1 ISBN978-3-642-22143-9