input word = C00050207

Metabolite InformationStructural formula
Name Pyridinebetaine A
Formula C8H9NO3
Mw 167.05824316
CAS RN 52578-48-0
C_ID C00050207 ,
InChIKey IARUTNQUAKTSAY-UHFFFAOYSA-N
InChICode InChI=1S/C8H10NO3/c10-5-4-9-3-1-2-7(6-9)8(11)12/h1-3,6,10H,4-5H2,(H,11,12)
SMILES c1c(cccn1CCO)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAgelasidaeAgelas dispar Ref.
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