input word = C00027303

Metabolite InformationStructural formula
Name beta-Hydrastine
Formula C21H21NO6
Mw 383.13688741
CAS RN 118-08-1
C_ID C00027303 ,
InChIKey JZUTXVTYJDCMDU-QINVSXPYNA-N
InChICode InChI=1S/C21H21NO6/c1-22-7-6-11-8-15-16(27-10-26-15)9-13(11)18(22)19-12-4-5-14(24-2)20(25-3)17(12)21(23)28-19/h4-5,8-9,18-19H,6-7,10H2,1-3H3/t18-,19+/m1/s1
SMILES c12c(cc3c(c1)[C@@H](N(CC3)C)[C@@H]1c3c(C(=O)O1)c(c(cc3)OC)OC)OCO2
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeFumariaceaeCorydalis caucasia Ref.
PlantaeFumariaceaeFumaria bastardii Ref.
PlantaeRanunculaceae/HydrastidaceaeHydrastis canadensis Ref.
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