2-({(1E)-1-[(3R,4R,5S)-3-Acetoxy-4-Hydroxy-1-Azabicyclo[3.1.0]Hex-2-Ylidene]-2-Oxo-2-[(2-Oxopropyl)Amino]Ethyl}Amino)-1-(2-Methyl-2-Oxiranyl)-2-Oxoethyl 3-Methoxy-5-Methyl-1-Naphthoate

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Properties Simple | Detailed

Formula C30H33N3O10
IUPAC Name [(1s)-2-[[(1e)-2-(acetonylamino)-1-[(1r,3r,4r,5r)-3-acetoxy-4-hydroxy-1-azabicyclo[3.1.0]hexan-2-ylidene]-2-oxo-ethyl]amino]-1-[(2s)-2-methyloxiran-2-yl]-2-oxo-ethyl] 3-methoxy-5-methyl-naphthalene-1-carboxylate
Molecular Mass 595.597 g·mol−1
Heat of Formation -1278.0 ± 16.7 kJ·mol−1
Dipole Moment 4.86 ± 1.08 D
Volume 696.11 Å 3
Surface Area 547.15 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy -0.89 ± eV
Point Group Symmetry C1
InChIKey PBRHVAKBKPQZAF-WRXRCRTLSA-N
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