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3-Methoxy-5-methyl-naphthalene-1-carboxylic acid (S)-{[(R)-1-aza-bicyclo[3.1.0]hex-(2E)-ylidene-ethoxycarbonyl-methyl]-carbamoyl}-((S)-2-methyl-oxiranyl)-methyl ester

View entire compound with spectra: 1 MS (GC)

3-Methoxy-5-methyl-naphthalene-1-carboxylic acid (S)-{[(R)-1-aza-bicyclo[3.1.0]hex-(2E)-ylidene-ethoxycarbonyl-methyl]-carbamoyl}-((S)-2-methyl-oxiranyl)-methyl ester
SpectraBase Compound ID Ecd6Zou1PBb
InChI InChI=1S/C27H30N2O7/c1-5-34-26(32)22(21-10-9-16-13-29(16)21)28-24(30)23(27(3)14-35-27)36-25(31)20-12-17(33-4)11-19-15(2)7-6-8-18(19)20/h6-8,11-12,16,23H,5,9-10,13-14H2,1-4H3,(H,28,30)/b22-21+/t16-,23-,27+,29?/m1/s1
InChIKey OJEYPYZFDVAISH-KLNQCKJRSA-N
Mol Weight 494.54 g/mol
Molecular Formula C27H30N2O7
Exact Mass 494.205301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LiRqoFLUFxj
Name 3-Methoxy-5-methyl-naphthalene-1-carboxylic acid (S)-{[(R)-1-aza-bicyclo[3.1.0]hex-(2E)-ylidene-ethoxycarbonyl-methyl]-carbamoyl}-((S)-2-methyl-oxiranyl)-methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30N2O7
InChI InChI=1S/C27H30N2O7/c1-5-34-26(32)22(21-10-9-16-13-29(16)21)28-24(30)23(27(3)14-35-27)36-25(31)20-12-17(33-4)11-19-15(2)7-6-8-18(19)20/h6-8,11-12,16,23H,5,9-10,13-14H2,1-4H3,(H,28,30)/b22-21+/t16-,23-,27+,29?/m1/s1
InChIKey OJEYPYZFDVAISH-KLNQCKJRSA-N
Molecular Weight 494.544 g/mol
SMILES N(\C(=C/1N2C[C@]2(CC1)[H])C(=O)OCC)C([C@]([C@]1(OC1)C)(OC(c1c2c(cc(c1)OC)c(ccc2)C)=O)[H])=O
SPLASH splash10-0002-0930000000-c6710a11fd5c577cf4df
Source of Spectrum F-59-3037-4d
Synonyms Ethyl 2-[(R)-1-azabicyclo[3.1.0]hex-2-ylidene]-2-[(2S,3S)-3,4-Epooxy-2-(3-methoxy-5-methyl-1-naphthoylbutyryl]aminoacetate 3-Methoxy-5-methyl-1-naphthalenecarboxylic acid [(1S)-2-[[(1E)-1-[(1R)-5-azabicyclo[3.1.0]hexan-4-ylidene]-2-ethoxy-2-oxoethyl]amino]-1-[(2S)-2-methyl-2-oxiranyl]-2-oxoethyl] ester [(1S)-2-[[(1E)-1-[(1R)-5-azabicyclo[3.1.0]hexan-4-ylidene]-2-ethoxy-2-oxoethyl]amino]-1-[(2S)-2-methyloxiran-2-yl]-2-oxoethyl] 3-methoxy-5-methylnaphthalene-1-carboxylate [(1S)-2-[[(1E)-1-[(1R)-5-azabicyclo[3.1.0]hexan-4-ylidene]-2-ethoxy-2-oxo-ethyl]amino]-1-[(2S)-2-methyloxiran-2-yl]-2-oxo-ethyl] 3-methoxy-5-methyl-naphthalene-1-carboxylate [(1S)-2-[[(1E)-1-[(1R)-5-azabicyclo[3.1.0]hexan-4-ylidene]-2-ethoxy-2-oxidanylidene-ethyl]amino]-1-[(2S)-2-methyloxiran-2-yl]-2-oxidanylidene-ethyl] 3-methoxy-5-methyl-naphthalene-1-carboxylate
Wiley ID 1712210