input word = C00025517

Metabolite InformationStructural formula
Name Maingayine
Formula C21H27NO
Mw 309.20926449
CAS RN 27317-25-5
C_ID C00025517 ,
InChIKey BQDQUFADQUPXAM-BYBPWQIQNA-N
InChICode InChI=1S/C21H27NO/c1-13-17-5-6-19-16-4-3-14-11-15(23)7-9-20(14,2)18(16)8-10-21(17,19)12-22-13/h7,9,11-13,16-19H,3-6,8,10H2,1-2H3/t13-,16+,17+,18-,19-,20?,21-/m0/s1
SMILES C[C@@H]1N=C[C@]23CC[C@H]4[C@@H](CCC5=CC(=O)C=C[C@@]54C)[C@@H]2CC[C@H]13
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeParavallaris maingayi Ref.
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