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
Properties
Property | Value |
---|---|
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 |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |