(+)Neoclausenamide

AlkaPlorer ID: AK017416

Synonym: None

IUPAC Name: (3R,4S,5R)-3-hydroxy-5-[(S)-hydroxy(phenyl)methyl]-1-methyl-4-phenylpyrrolidin-2-one

Structure

SMILES: CN1C(=O)[C@H](O)[C@@H](C2=CC=CC=C2)[C@@H]1[C@@H](O)C1=CC=CC=C1

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InChI: InChI=1S/C18H19NO3/c1-19-15(16(20)13-10-6-3-7-11-13)14(17(21)18(19)22)12-8-4-2-5-9-12/h2-11,14-17,20-21H,1H3/t14-,15+,16-,17+/m0/s1

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InChIKey: WGYGSZOQGYRGIP-VVLHAWIVSA-N

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Properties Information

Molecule Weight: 297.35400000000004

TPSA: 60.77000000000001

MolLogP: 1.7052999999999998

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
None NON-PROTEIN TARGET Activity -29.1 % 10.1016/j.bmcl.2009.03.018
None NON-PROTEIN TARGET Activity -2.5 % 10.1016/j.bmcl.2009.03.018
None NON-PROTEIN TARGET Activity -0.7 % 10.1016/j.bmcl.2009.03.018

Metabolism Information