input word = C00040400

Metabolite InformationStructural formula
Name Strychnobrasiline
Formula C22H26N2O3
Mw 366.19434271
CAS RN 34227-00-4
C_ID C00040400 ,
InChIKey XZIACDKZDCVKKQ-VTPGWUAQNA-N
InChICode InChI=1S/C22H26N2O3/c1-13-16-11-23(3)9-8-22-18-6-4-5-7-19(18)24(14(2)25)21(22)17(12-27-13)15(16)10-20(22)26/h4-7,11,13,15,17,21H,8-10,12H2,1-3H3/b16-11-/t13-,15+,17-,21+,22?/m1/s1
SMILES CC(=O)N1c2ccccc2[C@@]23CCN(C)/C=C4/[C@@H](C)OC[C@@H]([C@H]12)[C@H]4CC3=O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeLonganiaceaeStrychnos brasiliensis Ref.
PlantaeLonganiaceaeStrychnos myrtoides Ref.
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