Rhombifoline

AlkaPlorer ID: AK014493

Synonym: 'Rhombifoline', '(-)-Rhombifoline', '(1R)-3-(3-Butenyl)-1,2,3,4,5,6-hexahydro-1,5-methano-8H-pyrido1,2-a1,4diazocin-8-one'

IUPAC Name: (1S,9R)-11-but-3-enyl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

Structure

SMILES: C=CCCN1C[C@H]2C[C@@H](C1)C1=CC=CC(=O)N1C2

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InChI: InChI=1S/C15H20N2O/c1-2-3-7-16-9-12-8-13(11-16)14-5-4-6-15(18)17(14)10-12/h2,4-6,12-13H,1,3,7-11H2/t12-,13+/m1/s1

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InChIKey: ZVTFRRVBMAUIQW-OLZOCXBDSA-N

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Properties Information

Molecule Weight: 244.338

TPSA: 25.24

MolLogP: 1.8435

Number of H-Donors: 0

Number of H-Acceptors: 3

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information