Virgilidone

AlkaPlorer ID: AK141156

Synonym: ''

IUPAC Name: (1R,2R,9S)-7,11-diazatricyclo[7.3.1.02,7]tridecan-8-one

Structure

SMILES: O=C1[C@@H]2CNC[C@@H](C2)[C@H]2CCCCN12

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InChI: InChI=1S/C11H18N2O/c14-11-9-5-8(6-12-7-9)10-3-1-2-4-13(10)11/h8-10,12H,1-7H2/t8-,9+,10-/m1/s1

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InChIKey: JTEWAGIMBZUVTB-KXUCPTDWSA-N

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Reference

PubChem CID: 15690942

SuperNatural Ⅲ: SN0174555-02

NPASS: NPC302960

Properties Information

Molecule Weight: 194.278

TPSA: 32.34

MolLogP: 0.6067999999999998

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information