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Littorine

AlkaPlorer ID: AK022477

Synonym: 'littorine', '', 'Littorine'

IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-hydroxy-3-phenylpropanoate

Structure

SMILES: CN1C2CCC1CC(OC(=O)[C@H](O)CC1=CC=CC=C1)C2

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InChI: InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)11-15(10-13)21-17(20)16(19)9-12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13?,14?,15?,16-/m1/s1

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InChIKey: FNRXUEYLFZLOEZ-LGGPCSOHSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Duboisia leichhardtii Duboisia Solanaceae Solanales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 289.37500000000006

TPSA？: 49.77

MolLogP？: 1.7583999999999995

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

AKRT ID Reaction Reaction Link ID
AKRT010521 CN1C2CCC1CC(O)C2.O=C(O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)Cc1ccccc1>>CN1C2CCC1CC(OC(=O)[C@H](O)Cc1ccccc1)C2 R08432
AKRT010522 CN1C2CCC1CC(OC(=O)[C@H](O)Cc1ccccc1)C2>>CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)[C@H](C=O)c1ccccc1)C2 R12954