Methyl {(5S,8S,10S,11S,14S)-11-Benzyl-10-Hydroxy-15,15-Dimethyl-5-(2-Methyl-2-Propanyl)-3,6,13-Trioxo-8-[4-(2-Pyridinyl)Benzyl]-2-Oxa-4,7,12-Triazahexadecan-14-Yl}Carbamate
Properties
Property | Value |
---|---|
Formula | C39H53N5O7 |
IUPAC Name | methyl n-[(1s)-1-[[(1s,2s,4s)-1-benzyl-2-hydroxy-4-[[(2s)-2-(methoxycarbonylamino)-3,3-dimethyl-butanoyl]amino]-5-[4-(2-pyridyl)phenyl]pentyl]carbamoyl]-2,2-dimethyl-propyl]carbamate |
Molecular Mass | 703.867 g·mol−1 |
Heat of Formation | -1272.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.96 ± 1.08 D |
Volume | 907.25 Å 3 |
Surface Area | 663.94 Å 2 |
HOMO Energy | -9.20 ± 0.55 eV |
LUMO Energy | -0.67 ± eV |
Point Group Symmetry | C1 |
InChIKey | GFEQPJLSPPMUEG-VYIXFUBHSA-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 |