Dehydrolycopecurine

AlkaPlorer ID: AK119253

Synonym: '5-Ketone-lycopecurine'

IUPAC Name: (1R,2R,4S,10R,13S,15S)-15-methyl-6-azapentacyclo[8.6.0.01,6.02,13.04,10]hexadecan-11-one

Structure

SMILES: C[C@H]1C[C@H]2CC(=O)[C@]34CCCN5C[C@H]3C[C@H]2[C@@]54C1

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InChI: InChI=1S/C16H23NO/c1-10-5-11-6-14(18)15-3-2-4-17-9-12(15)7-13(11)16(15,17)8-10/h10-13H,2-9H2,1H3/t10-,11-,12+,13+,15-,16+/m0/s1

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InChIKey: DUOHSCVPPHHTTP-NISPOYCLSA-N

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Properties Information

Molecule Weight: 245.366

TPSA: 20.31

MolLogP: 2.476000000000001

Number of H-Donors: 0

Number of H-Acceptors: 2

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information