2-Methyl-6-tridecylpiperidine; (2R,6S)-form, 4',5'-Didehydro(Z-) 

AlkaPlorer ID: AK306394

Synonym: 4',5'-Dehydroisosolenopsine B, 4',5'-Didehydroisosolenopsine B

IUPAC Name: 2-methyl-6-[(E)-tridec-4-enyl]piperidine

Structure

SMILES: CCCCCCCC/C=C/CCCC1CCCC(C)N1

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InChI: InChI=1S/C19H37N/c1-3-4-5-6-7-8-9-10-11-12-13-16-19-17-14-15-18(2)20-19/h10-11,18-20H,3-9,12-17H2,1-2H3/b11-10+

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InChIKey: KGZVUZULXQDUBG-ZHACJKMWSA-N

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Reference

PubChem CID: 68554503

CAS: 1150095-53-6

Properties Information

Molecule Weight: 279.51199999999994

TPSA: 12.03

MolLogP: 5.994100000000006

Number of H-Donors: 1

Number of H-Acceptors: 1

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information