Aspidospermidine; (+)-form, N1-Ac
AlkaPlorer ID: AK289553
Synonym: N-Acetylaspidospermidine, Demethoxyaspidospermine
IUPAC Name: 1-(12-ethyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6-trien-8-yl)ethanone
Structure
SMILES: CCC12CCCN3CCC4(C5=CC=CC=C5N(C(C)=O)C4CC1)C32
InChI: InChI=1S/C21H28N2O/c1-3-20-10-6-13-22-14-12-21(19(20)22)16-7-4-5-8-17(16)23(15(2)24)18(21)9-11-20/h4-5,7-8,18-19H,3,6,9-14H2,1-2H3
InChIKey: GAVJVWWZBPAPEL-UHFFFAOYSA-N
Source
Properties Information
Molecule Weight: 324.46800000000013
TPSA？: 23.55
MolLogP？: 3.717800000000003
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 5
Activities Information
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