Jolantamine

AlkaPlorer ID: AK291159

Synonym: Alkaloid K8, Alkaloid MJ1, Iolantamine

IUPAC Name: 6-hydroxy-5-methoxy-1-methylspiro[3,8,9,9a-tetrahydro-2H-benzo[de]quinoline-7,4'-cyclohex-2-ene]-1'-one

Structure

SMILES: COC1=CC2=C3C(=C1O)C1(C=CC(=O)CC1)CCC3N(C)CC2

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InChI: InChI=1S/C19H23NO3/c1-20-10-6-12-11-15(23-2)18(22)17-16(12)14(20)5-9-19(17)7-3-13(21)4-8-19/h3,7,11,14,22H,4-6,8-10H2,1-2H3

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InChIKey: WJUUEQJJDGQOOB-UHFFFAOYSA-N

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Reference

PubChem CID: 628552

COCONUT: CNP0152634.2

Properties Information

Molecule Weight: 313.39700000000005

TPSA: 49.77

MolLogP: 2.8805000000000014

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information