3-Hydroxy-5-methyl-1-naphthalenecarboxylic acid; Me ether, [1-(aminocarbonyl)-2,3-epoxy-2-methylpropyl] ester(1S,2S-) 

AlkaPlorer ID: AK301520

Synonym: None

IUPAC Name: [2-amino-1-(2-methyloxiran-2-yl)-2-oxoethyl] 3-methoxy-5-methylnaphthalene-1-carboxylate

Structure

SMILES: COC1=CC2=C(C)C=CC=C2C(C(=O)OC(C(=N)O)C2(C)CO2)=C1

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InChI: InChI=1S/C18H19NO5/c1-10-5-4-6-12-13(10)7-11(22-3)8-14(12)17(21)24-15(16(19)20)18(2)9-23-18/h4-8,15H,9H2,1-3H3,(H2,19,20)

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InChIKey: KDYGKLQSWCCUFT-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 329.3520000000001

TPSA: 92.14

MolLogP: 3.006390000000001

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information