input word = C00025566

Metabolite InformationStructural formula
Name Schizanthine B
Formula C31H44N2O8
Mw 572.3097664
CAS RN 70474-25-8
C_ID C00025566 ,
InChIKey ZDZMTNGYZHLLRC-GRSHGNNSNA-N
InChICode InChI=1S/C31H44N2O8/c1-17(2)8-28(34)40-26-13-20-11-22(15-24(26)32(20)6)38-30(36)10-19(5)31(37)39-23-12-21-14-27(25(16-23)33(21)7)41-29(35)9-18(3)4/h8-10,20-27H,11-16H2,1-7H3/b19-10-/t20-,21+,22+,23-,24+,25-,26-,27+/m0/s1
SMILES CC(C)=CC(=O)OC1CC2CC(OC(=O)/C=C(/C)C(=O)OC3CC4CC(OC(=O)C=C(C)C)C(C3)N4C)CC1N2C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg L-Asp
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeSchizanthus pinnatus Ruiz et Pav. Ref.
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OrganismSchizanthus pinnatus Ruiz et Pav.
ReferenceG.de la Fuente,Heterocycles,27,(1988),1887