Cas no 20194-55-2 (1-Methoxy-13-oxoallocryptopine)

1-Methoxy-13-oxoallocryptopine structure
20194-55-2 structure
Product Name:1-Methoxy-13-oxoallocryptopine
CAS No:20194-55-2
MF:C22H23NO7
MW:413.420526742935
CID:6767006
Update Time:2024-03-03

1-Methoxy-13-oxoallocryptopine Chemical and Physical Properties

Names and Identifiers

    • Oreonone
    • 1-Methoxy-13-oxoallocryptopine
    • Inchi: 1S/C22H23NO7/c1-23-8-7-12-9-16-21(30-11-29-16)22(28-4)17(12)19(25)18(24)13-5-6-15(26-2)20(27-3)14(13)10-23/h5-6,9H,7-8,10-11H2,1-4H3
    • InChI Key: PERSMPLCTGDLHL-UHFFFAOYSA-N
    • SMILES: C12OCOC1=CC1CCN(C)CC3C(OC)=C(OC)C=CC=3C(=O)C(=O)C=1C=2OC

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 30
  • XLogP3: 0.98
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