Cas no 85644-15-1 (stemotinine)

stemotinine structure
stemotinine structure
Product Name:stemotinine
CAS No:85644-15-1
MF:C18H25NO5
MW:335.394805669785
CID:2002367
Update Time:2025-04-21

stemotinine Chemical and Physical Properties

Names and Identifiers

    • stemotinine
    • Inchi: 1S/C18H25NO5/c1-10-7-14(22-15(10)20)13-4-6-18-17(8-11(2)16(21)24-17)5-3-12(23-18)9-19(13)18/h10-14H,3-9H2,1-2H3
    • InChI Key: GRCVOPKGGZCLPF-UHFFFAOYSA-N
    • SMILES: CC1C(=O)OC(C2N3C4(C5(OC(=O)C(C)C5)CCC(C3)O4)CC2)C1

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 24
  • XLogP3: 1.589

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