input word = C00064110

Metabolite InformationStructural formula
Name Pegaharmine C
Formula C16H16N2O2
Mw 268.12117777
CAS RN 1962990-19-7
C_ID C00064110
InChIKey CEUJTALCRXJNGR-MRXNPFEDSA-N
InChICode InChI=1S/C16H16N2O2/c1-16-7-5-14(19)18(16)8-6-12-11-4-3-10(20-2)9-13(11)17-15(12)16/h3-5,7,9,17H,6,8H2,1-2H3/t16-/m1/s1
SMILES COc1ccc2c3c([nH]c2c1)C1(C)C=CC(=O)N1CC3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeNitrariaceaePeganum harmala Ref.
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OrganismPeganum harmala
ReferenceSingh, B and Sharma, R. V., Secondary Metabolites of Medicinal Plants, Vol. 3, (2020), Wiley-VCH Verlag GmbH and Co. KGaA.