input word = C00025539

Metabolite InformationStructural formula
Name Erysothiovine
Formula C20H23NO7S
Mw 421.11952283
CAS RN 466-79-5
C_ID C00025539 ,
InChIKey TZPLXTDTCOMZQQ-SBUNUNJWNA-N
InChICode InChI=1S/C20H23NO7S/c1-26-15-4-3-14-6-8-21-7-5-13-9-17(27-2)18(10-16(13)20(14,21)11-15)28-29(24,25)12-19(22)23/h3-4,6,9-10,15H,5,7-8,11-12H2,1-2H3,(H,22,23)/t15-,20-/m0/s1
SMILES c1(c(cc2c(c1)[C@@]13N(CC2)CC=C1C=C[C@@H](C3)OC)OC)OS(=O)(=O)CC(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeFabaceaeErythrina glauca Willd. Ref.
zoom in