input word = C00027382

Metabolite InformationStructural formula
Name Isoboldine beta-N-oxide
Formula C19H21NO5
Mw 343.14197279
CAS RN 377088-58-9
C_ID C00027382 ,
InChIKey MMMBWFLXCHRYGD-LZAPVJCENA-N
InChICode InChI=1S/C19H21NO5/c1-20(23)5-4-10-8-16(25-3)19(22)18-12-9-15(24-2)14(21)7-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3/t13-,20+/m0/s1
SMILES COc1cc2c(cc1O)C[C@H]1c3c(cc(OC)c(O)c3-2)CC[N+]1(C)[O-]
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeLauraceaeCryptocarya chinensis Ref.
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