Pericyclivine

AlkaPlorer ID: AK553999

Synonym: None

IUPAC Name: methyl (1S,14S,15E)-15-ethylidene-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carboxylate

Structure

SMILES: C/C=C1/CN2C3CC4=C(NC5=CC=CC=C45)[C@@H]2C[C@H]1C3C(=O)OC

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InChI: InChI=1S/C20H22N2O2/c1-3-11-10-22-16-9-14-12-6-4-5-7-15(12)21-19(14)17(22)8-13(11)18(16)20(23)24-2/h3-7,13,16-18,21H,8-10H2,1-2H3/b11-3-/t13-,16?,17+,18?/m1/s1

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InChIKey: VXRAIAAMNNTQES-PSPRVUNFSA-N

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Source

Properties Information

Molecule Weight: 322.4080000000001

TPSA: 45.33

MolLogP: 3.2047000000000017

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information