Pyrifolidine; (-)-form, Di-O-de-Me
AlkaPlorer ID: AK311913
Synonym: O-Demethylaspidocarpine
IUPAC Name: 1-(12-ethyl-5,6-dihydroxy-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2(7),3,5-trien-8-yl)ethanone
Structure
SMILES: CCC12CCCN3CCC4(C5=CC=C(O)C(O)=C5N(C(C)=O)C4CC1)C32
InChI: InChI=1S/C21H28N2O3/c1-3-20-8-4-11-22-12-10-21(19(20)22)14-5-6-15(25)18(26)17(14)23(13(2)24)16(21)7-9-20/h5-6,16,19,25-26H,3-4,7-12H2,1-2H3
InChIKey: HFWWOCILOBWUNN-UHFFFAOYSA-N
Source
Properties Information
Molecule Weight: 356.4660000000002
TPSA？: 64.01
MolLogP？: 3.129000000000003
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 5
Activities Information
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