(2S)-2-({(1E)-1-[(9Br)-6-Acetyl-7,9-Dihydroxy-8,9B-Dimethyl-1,3-Dioxo-3,9B-Dihydrodibenzo[B,D]Furan-2(1H)-Ylidene]Ethyl}Amino)-5-Methoxy-5-Oxopentanoic Acid (Non-Preferred Name)
Properties
Property | Value |
---|---|
Formula | C24H25NO10 |
IUPAC Name | (2s)-2-[[(1z)-1-[(9br)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-1,3-dioxo-dibenzofuran-2-ylidene]ethyl]amino]-5-methoxy-5-oxo-pentanoic acid |
Molecular Mass | 487.456 g·mol−1 |
Heat of Formation | -1705.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.99 ± 1.08 D |
Volume | 539.6 Å 3 |
Surface Area | 440.49 Å 2 |
HOMO Energy | -9.01 ± 0.55 eV |
LUMO Energy | 2.14 ± eV |
Point Group Symmetry | C1 |
InChIKey | KSWPDJNHLSRGKZ-YMCIUTNHSA-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 |