Cas no 181284-52-6 (13-Ethyl-1a,4,5,10,11,12,13,13a-octahydro-2H-3,13-methanooxireno[9,10]azacycloundecino[5,4-b]indole; (+)-form, 16β-Hydroxy)

13-Ethyl-1a,4,5,10,11,12,13,13a-octahydro-2H-3,13-methanooxireno[9,10]azacycloundecino[5,4-b]indole; (+)-form, 16β-Hydroxy structure
181284-52-6 structure
Product Name:13-Ethyl-1a,4,5,10,11,12,13,13a-octahydro-2H-3,13-methanooxireno[9,10]azacycloundecino[5,4-b]indole; (+)-form, 16β-Hydroxy
CAS No:181284-52-6
MF:C19H24N2O2
MW:312.406064987183
CID:2720951
Update Time:2024-03-03

13-Ethyl-1a,4,5,10,11,12,13,13a-octahydro-2H-3,13-methanooxireno[9,10]azacycloundecino[5,4-b]indole; (+)-form, 16β-Hydroxy Chemical and Physical Properties

Names and Identifiers

    • 13-Ethyl-1a,4,5,10,11,12,13,13a-octahydro-2H-3,13-methanooxireno[9,10]azacycloundecino[5,4-b]indole; (+)-form, 16β-Hydroxy
    • Inchi: 1S/C19H24N2O2/c1-2-19-9-15(22)17-13(12-5-3-4-6-14(12)20-17)7-8-21(11-19)10-16-18(19)23-16/h3-6,15-16,18,20,22H,2,7-11H2,1H3
    • InChI Key: WGCPUCHCVZSNEQ-UHFFFAOYSA-N
    • SMILES: CCC12CC(O)C3NC4C(C=3CCN(CC3C1O3)C2)=CC=CC=4

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 23
  • XLogP3: 1.826
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