Lycophlegmarine

AlkaPlorer ID: AK049914

Synonym: ''

IUPAC Name: (1S,6S,8S,9E)-8-hydroxy-3-methoxy-4,13-dimethyl-13-azatricyclo[7.7.0.01,6]hexadeca-3,9-dien-2-one

Structure

SMILES: COC1=C(C)C[C@H]2C[C@H](O)/C3=C/CCN(C)CCC[C@@]32C1=O

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InChI: InChI=1S/C18H27NO3/c1-12-10-13-11-15(20)14-6-4-8-19(2)9-5-7-18(13,14)17(21)16(12)22-3/h6,13,15,20H,4-5,7-11H2,1-3H3/b14-6-/t13-,15-,18-/m0/s1

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InChIKey: QVPREBHRCCEOMO-RRKMOMQRSA-N

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Source

Properties Information

Molecule Weight: 305.41800000000006

TPSA: 49.77

MolLogP: 2.2889

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information