input word = C00050999

Metabolite InformationStructural formula
Name Isostrychnine
Formula C21H22N2O2
Mw 334.16812796
CAS RN 467-16-3
C_ID C00050999
InChIKey PNYOGGAOQVIZDM-XHGHAPFCNA-N
InChICode InChI=1S/C21H22N2O2/c24-10-7-13-12-22-9-8-21-16-3-1-2-4-17(16)23-19(25)6-5-14(20(21)23)15(13)11-18(21)22/h1-5,7,15,18,20,24H,6,8-12H2/b13-7-/t15-,18-,20-,21+/m0/s1
SMILES O=C1CC=C2[C@H]3C[C@@H]4N(CC[C@@]45c4ccccc4N1[C@@H]25)C/C3=C/CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLonganiaceaeStrychnos nux-vomica Ref.
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