(3S,3Ar,5R,6Ar)-3-[(Methoxycarbonyl)Amino]Hexahydro-2H-Cyclopenta[B]Furan-5-Yl [(2S,3R)-3-Hydroxy-4-{Isobutyl[(4-Methoxyphenyl)Sulfonyl]Amino}-1-Phenyl-2-Butanyl]Carbamate
Properties
Property | Value |
---|---|
Formula | C31H43N3O9S |
IUPAC Name | methyl n-[(3s,3ar,5r,6ar)-5-[[(1s,2r)-1-benzyl-2-hydroxy-3-[isobutyl-(4-methoxyphenyl)sulfonyl-amino]propyl]carbamoyloxy]-3,3a,4,5,6,6a-hexahydro-2h-cyclopenta[b]furan-3-yl]carbamate |
Molecular Mass | 633.753 g·mol−1 |
Heat of Formation | -1566.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.04 ± 1.08 D |
Volume | 753.19 Å 3 |
Surface Area | 562.33 Å 2 |
HOMO Energy | -9.16 ± 0.55 eV |
LUMO Energy | -0.41 ± eV |
Point Group Symmetry | C1 |
InChIKey | XXQYXAWGNBWMGJ-YZGPKJBYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C S O N |