(4Ar,6S,7R,7As)-4-Carbamoyl-6-Hydroxy-7-{[(L-Isoleucylsulfamoyl)Acetyl]Amino}-2-Methyl-2,4A,5,6,7,7A-Hexahydro-1H-Cyclopenta[C]Pyridine-7-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C19H31N5O8S |
IUPAC Name | (4ar,6s,7r,7as)-7-[[2-[[(2s,3s)-2-amino-3-methyl-pentanoyl]sulfamoyl]acetyl]amino]-4-carbamoyl-6-hydroxy-2-methyl-4a,5,6,7a-tetrahydro-1h-cyclopenta[c]pyridine-7-carboxylic acid |
Molecular Mass | 489.543 g·mol−1 |
Heat of Formation | -1512.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.45 ± 1.08 D |
Volume | 542.14 Å 3 |
Surface Area | 407.42 Å 2 |
HOMO Energy | -8.76 ± 0.55 eV |
LUMO Energy | -0.03 ± eV |
Point Group Symmetry | C1 |
InChIKey | HDXFGBFIEQUETL-IVWWPFAYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |