[(1S,2R,3R,4S,5S)-4-Amino-3-[(Dimethylcarbamoyl)Amino]-5-[(3-Glycoloylphenyl)Amino]-1,2-Dihydroxy-3-(1-Hydroxyethyl)-2-Methylcyclopentyl]Methyl 2-Hydroxy-6-Methylbenzoate
Properties
Property | Value |
---|---|
Formula | C28H38N4O9 |
IUPAC Name | [(1s,2r,3r,4s,5s)-4-amino-3-(dimethylcarbamoylamino)-1,2-dihydroxy-5-[3-(2-hydroxyacetyl)anilino]-3-[(1r)-1-hydroxyethyl]-2-methyl-cyclopentyl]methyl 2-hydroxy-6-methyl-benzoate |
Molecular Mass | 574.623 g·mol−1 |
Heat of Formation | -1575.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.36 ± 1.08 D |
Volume | 666.71 Å 3 |
Surface Area | 476.2 Å 2 |
HOMO Energy | -8.83 ± 0.55 eV |
LUMO Energy | -0.69 ± eV |
Point Group Symmetry | C1 |
InChIKey | REZOEBXINKYJRQ-YWBDCRNOSA-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 |