input word = C00027029

Metabolite InformationStructural formula
Name Brevicompanine B
(-)-Brevicompanine B
Formula C22H29N3O2
Mw 367.22597719
CAS RN 215121-47-4
C_ID C00027029 ,
InChIKey XOXYXMVEUVFULA-IZGWOOPPNA-N
InChICode InChI=1S/C22H29N3O2/c1-6-13(3)17-19(27)25-16(18(26)24-17)12-22(21(4,5)7-2)14-10-8-9-11-15(14)23-20(22)25/h7-11,13,16-17,20,23H,2,6,12H2,1,3-5H3,(H,24,26)/t13-,16+,17-,20+,22-/m1/s1
SMILES c1ccc2c(c1)N[C@@H]1[C@]2(C[C@@H]2N1C(=O)[C@H](NC2=O)[C@@H](CC)C)C(C)(C)C=C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-His
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium brevicompactum Ref.
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