input word = C00025567

Metabolite InformationStructural formula
Name Schizanthine C
Formula C26H38N2O6
Mw 474.27298696
CAS RN 109031-02-9
C_ID C00025567 ,
InChIKey CNZQGLUNWSBMAN-MIVMAWHANA-N
InChICode InChI=1S/C26H38N2O6/c1-6-15(2)25(30)34-23-13-19-12-21(14-22(23)28(19)5)32-24(29)9-16(3)26(31)33-20-10-17-7-8-18(11-20)27(17)4/h6,9,17-23H,7-8,10-14H2,1-5H3/b15-6-,16-9+/t17-,18+,19-,20+,21-,22+,23-/m1/s1
SMILES C1[C@H]([C@@H]2C[C@@H](C[C@H]1N2C)OC(=O)/C=C(/C(=O)O[C@H]1C[C@H]2CC[C@@H](C1)N2C)\C)OC(=O)/C(=C\C)/C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg L-Asp
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeSchizanthus grahamii Ref.
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OrganismSchizanthus grahamii
ReferenceSan-Martin,Phytochem.,26,(1987),819