Norsecurinine; (+)-form, 4ξ-Methoxy

AlkaPlorer ID: AK308188

Synonym: 4-Methoxynorsecurinine

IUPAC Name: 11-methoxy-2-oxa-9-azatetracyclo[6.5.1.01,5.09,13]tetradeca-4,6-dien-3-one

Structure

SMILES: COC1CC2N(C1)C1C=CC3=CC(=O)OC32C1

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InChI: InChI=1S/C13H15NO3/c1-16-10-5-11-13-6-9(14(11)7-10)3-2-8(13)4-12(15)17-13/h2-4,9-11H,5-7H2,1H3

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InChIKey: WTUGFBFFNZHNEK-UHFFFAOYSA-N

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Reference

PubChem CID: 163068051

CAS: 91653-34-8

COCONUT: CNP0359754.1

Source

Properties Information

Molecule Weight: 233.267

TPSA: 38.77

MolLogP: 0.6397999999999999

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information