input word = C00039906

Metabolite InformationStructural formula
Name Orisuaveoline B
Formula C20H15N3O4
Mw 361.10625599
CAS RN 1105671-14-4
C_ID C00039906 ,
InChIKey XQLMMQLYXOMQKO-UHFFFAOYSA-N
InChICode InChI=1S/C20H15N3O4/c1-25-10-2-3-12-14(6-10)22-19-18-11(4-5-23(19)20(12)24)13-7-16-17(27-9-26-16)8-15(13)21-18/h2-3,6-8,21H,4-5,9H2,1H3
SMILES c12c(c3n(CC1)c(=O)c1c(n3)cc(cc1)OC)[nH]c1c2cc2c(c1)OCO2
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeRutaceaeOricia suaveolens Ref.
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