Formula |
C20H32N6O12S2 |
IUPAC Name |
(2s)-2-amino-4-[[(2s)-3-[[(2s)-3-[[(3s)-3-amino-3-carboxy-propyl]amino]-2-[(2-carboxyacetyl)amino]-3-oxo-propyl]disulfanyl]-2-[(2-carboxyacetyl)amino]propanoyl]amino]butanoic acid |
Molecular Mass |
612.631 g·mol−1 |
Heat of Formation |
-2320.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
0.45 ± 1.08 D |
Volume |
695.27 Å 3 |
Surface Area |
540.45 Å 2 |
HOMO Energy |
-9.19 ± 0.55 eV |
LUMO Energy |
-1.25 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (2s)-2-amino-4-[[(2s)-3-[(2s)-3-[[(3s)-3-amino-4-hydroxy-4-keto-butyl]amino]-2-[(3-hydroxy-3-keto-propanoyl)amino]-3-keto-propyl]disulfanyl-2-[(3-hydroxy-3-keto-propanoyl)amino]propanoyl]amino]butyric acid
- (2s)-2-amino-4-[[(2s)-3-[(2s)-3-[[(3s)-3-amino-4-hydroxy-4-oxo-butyl]amino]-2-[(3-hydroxy-3-oxo-propanoyl)amino]-3-oxo-propyl]disulfanyl-2-[(3-hydroxy-3-oxo-propanoyl)amino]propanoyl]amino]butanoic acid
- (2s)-2-amino-4-[[(2s)-3-[(2s)-3-[[(3s)-3-amino-4-hydroxy-4-oxobutyl]amino]-2-[(3-hydroxy-1,3-dioxopropyl)amino]-3-oxopropyl]disulfanyl-2-[(3-hydroxy-1,3-dioxopropyl)amino]-1-oxopropyl]amino]butanoic acid
- (2s)-2-amino-4-[[(2s)-3-[(2s)-3-[[(3s)-3-amino-4-hydroxy-4-oxobutyl]amino]-2-[(3-hydroxy-3-oxopropanoyl)amino]-3-oxopropyl]disulfanyl-2-[(3-hydroxy-3-oxopropanoyl)amino]propanoyl]amino]butanoic acid
|
InChIKey |
MRZMTLNHPCSZCE-NNYUYHANSA-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
|
|
|