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Pseudotropine

AlkaPlorer ID: AK002732

Synonym: None

IUPAC Name: (1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-ol

Structure

SMILES: CN1[C@@H]2CC[C@H]1C[C@H](O)C2

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InChI: InChI=1S/C8H15NO/c1-9-6-2-3-7(9)5-8(10)4-6/h6-8,10H,2-5H2,1H3/t6-,7+,8-

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InChIKey: CYHOMWAPJJPNMW-RNLVFQAGSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Fagopyrum tataricum Fagopyrum Polygonaceae Caryophyllales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Uvaria cuneifolia Uvaria Annonaceae Magnoliales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Sargassum yezoense Sargassum Sargassaceae Fucales Phaeophyceae None None Eukaryota
Acer palmatum Acer Sapindaceae Sapindales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Dioncophyllum thollonii Dioncophyllum Dioncophyllaceae Caryophyllales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Paeonia emodi Paeonia Paeoniaceae Saxifragales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Streptomyces flaveolus Streptomyces Streptomycetaceae Kitasatosporales Actinomycetes Actinomycetota None Bacteria
Achillea atrata Achillea Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Montanoa speciosa Montanoa Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Rhamnus davurica Rhamnus Rhamnaceae Rosales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Mus musculus Mus Muridae Rodentia Mammalia Chordata Metazoa Eukaryota
Phacelia minor Phacelia Hydrophyllaceae Boraginales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Lavandula multifida Lavandula Lamiaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Dermophis mexicanus Dermophis Dermophiidae Gymnophiona Amphibia Chordata Metazoa Eukaryota
Chenopodium album Chenopodium Chenopodiaceae Caryophyllales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Metapochonia suchlasporia Metapochonia Clavicipitaceae Hypocreales Sordariomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 141.21399999999997

TPSA？: 23.47

MolLogP？: 0.6038999999999999

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Electrophorus electricus Acetylcholinesterase Inhibition 1.27 % 10.1016/j.bmc.2012.09.040
Equus caballus Cholinesterase Inhibition -9.24 % 10.1016/j.bmc.2012.09.040

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT000397 *C(=O)O[C@H]1C[C@@H]2CC[C@H](C1)N2C>>CN1[C@H]2CC[C@@H]1C[C@@H](O)C2 MNXR150401
AKRT000461 *C(=O)[CoA].CN1[C@H]2CC[C@@H]1C[C@@H](O)C2>>*C(=O)OC1CC2CCC(C1)N2C MNXR177457
AKRT000462 *C(=O)[CoA].CN1[C@H]2CC[C@@H]1C[C@@H](O)C2>>*C(=O)O[C@H]1C[C@@H]2CC[C@H](C1)N2C RXN-9295
AKRT001451 C/C=C(\C)C(=O)[CoA].CN1[C@H]2CC[C@@H]1C[C@@H](O)C2>>C/C=C(\C)C(=O)O[C@H]1C[C@@H]2CC[C@H](C1)N2C enzymemap_29338
AKRT004529 CC(=O)[CoA].CN1[C@H]2CC[C@@H]1C[C@@H](O)C2>>CC(=O)OC1CC2CCC(C1)N2C MNXR149667
AKRT004530 CC(=O)[CoA].CN1[C@H]2CC[C@@H]1C[C@@H](O)C2>>CC(=O)O[C@H]1C[C@@H]2CC[C@H](C1)N2C enzymemap_29336
AKRT005379 CC(C)C(=O)[CoA].CN1[C@H]2CC[C@@H]1C[C@@H](O)C2>>CC(C)C(=O)O[C@H]1C[C@@H]2CC[C@H](C1)N2C enzymemap_29339
AKRT005462 CC(C)CC(=O)[CoA].CN1[C@H]2CC[C@@H]1C[C@@H](O)C2>>CC(C)CC(=O)O[C@H]1C[C@@H]2CC[C@H](C1)N2C enzymemap_29340
AKRT007167 CCC(=O)[CoA].CN1[C@H]2CC[C@@H]1C[C@@H](O)C2>>CCC(=O)O[C@H]1C[C@@H]2CC[C@H](C1)N2C enzymemap_29342
AKRT010593 CN1[C@H]2CC[C@@H]1CC(=O)C2>>CN1[C@H]2CC[C@@H]1C[C@@H](O)C2 TROPINONE-REDUCTASE-RXN
AKRT010596 CN1[C@H]2CC[C@@H]1C[C@@H](O)C2>>CN1[C@H]2CC[C@@H]1CC(=O)C2 enzymemap_3195
AKRT023458 O=C([CoA])Cc1ccccc1.CN1[C@H]2CC[C@@H]1C[C@@H](O)C2>>CN1[C@H]2CC[C@@H]1C[C@@H](OC(=O)Cc1ccccc1)C2 enzymemap_29337