input word = C00027500

Metabolite InformationStructural formula
Name Urabaine
Formula C36H32N2O4
Mw 556.23620752
CAS RN 108906-93-0
C_ID C00027500 ,
InChIKey VAJJHVOLCGLYEI-UHFFFAOYSA-N
InChICode InChI=1S/C36H32N2O4/c1-39-25-17-19-13-15-37-33-27(19)31(35(25)41-3)23-11-7-5-9-21(23)29(33)30-22-10-6-8-12-24(22)32-28-20(14-16-38-34(28)30)18-26(40-2)36(32)42-4/h5-12,17-18,37-38H,13-16H2,1-4H3
SMILES COc1cc2c3c(c(-c4c5c6c(cc(OC)c(OC)c6c6ccccc46)CCN5)c4ccccc4c3c1OC)NCC2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaePhoenicanthus obliqua Ref.
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