SCOPOLIN

Metabolite SCOPOLIN

• smiles:
  • COC2(=CC1(=C(OC(C=C1)=O)C=C2OC3(C(C(C(O)C(CO)O3)O)O)))
• molecular weight:
  • 354.313
• inchi key:
  • InChIKey=SGTCGCCQZOUMJJ-YMILTQATSA-N
• common name:
  • scopolin
• Synonym(s):

Reaction(s) known to consume the compound

• RXN-14179

External links

• METABOLIGHTS : MTBLC16065
• CAS : 531-44-2
• CHEMSPIDER:
  • 307225
• CHEBI:
  • 16065
• LIGAND-CPD:
  • C01527
• PUBCHEM:
  • 439514
• NCI:
  • 404560