None

AlkaPlorer ID: AK323461

Synonym: None

IUPAC Name: (1S,13S,15R,18R)-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2(10),3,8,16-tetraene-15,18-diol

Structure

SMILES: O[C@H]1C=C[C@@]23C4=C(C=C5CCCC5=C4)CN(C[C@@H]2O)[C@H]3C1

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InChI: InChI=1S/C18H21NO2/c20-14-4-5-18-15-7-12-3-1-2-11(12)6-13(15)9-19(10-17(18)21)16(18)8-14/h4-7,14,16-17,20-21H,1-3,8-10H2/t14-,16-,17-,18-/m0/s1

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InChIKey: IOTTUNXDZBJQGD-DKIMLUQUSA-N

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Reference

PubChem CID: 134131229

NPASS: NPC482914

Source

Properties Information

Molecule Weight: 283.371

TPSA: 43.7

MolLogP: 1.2926000000000002

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Electrophorus electricus Acetylcholinesterase IC50 200000.0 nM 10.1021/acs.jnatprod.5b00785
Equus caballus Cholinesterase IC50 200000.0 nM 10.1021/acs.jnatprod.5b00785

Metabolism Information