Hydroxy-N-methylcytisine

AlkaPlorer ID: AK007156

Synonym: None

IUPAC Name: (1S,9S)-8-hydroxy-11-methyl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

Structure

SMILES: CN1C[C@@H]2C[C@@H](C1)C3=CC=CC(=O)N3C2O

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InChI: InChI=1S/C12H16N2O2/c1-13-6-8-5-9(7-13)12(16)14-10(8)3-2-4-11(14)15/h2-4,8-9,12,16H,5-7H2,1H3/t8-,9-,12?/m0/s1

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InChIKey: XEYCQYZMQKENBX-VTGJNACWSA-N

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Properties Information

Molecule Weight: 220.27200000000002

TPSA: 45.47

MolLogP: 0.38809999999999995

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information