input word = C00064108

Metabolite InformationStructural formula
Name Pegaharmine A
Formula C24H22N4O3
Mw 414.1691906
CAS RN 1962990-17-5
C_ID C00064108
InChIKey UEIOHRQSCHPMLO-GBXCKJPGSA-N
InChICode InChI=1S/C24H22N4O3/c1-24-20(27-13-25-18-6-4-3-5-17(18)23(27)30)12-21(29)28(24)10-9-16-15-8-7-14(31-2)11-19(15)26-22(16)24/h3-8,11,13,20,26H,9-10,12H2,1-2H3/t20-,24+/m0/s1
SMILES COc1ccc2c3c([nH]c2c1)C1(C)C(n2cnc4ccccc4c2=O)CC(=O)N1CC3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeNitrariaceaePeganum harmala Ref.
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