7-{[(2-Amino-1,3-Thiazol-4-Yl){[(1,5-Dihydroxy-4-Oxo-1,4-Dihydro-2-Pyridinyl)Carbonyl]Amino}Acetyl]Amino}-3-({[1-(2-Hydroxyethyl)-4-Pyridiniumyl]Sulfanyl}Methyl)-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate

Molecule SVG Image

Properties Simple | Detailed

Formula C26H33N7O9S3+
IUPAC Name (6s,7s)-7-[[(2s)-2-(2-amino-5h-thiazol-3-ium-5-id-4-yl)-2-[(1,5-dihydroxy-4-oxo-piperidine-2,3,5,6-tetraide-2-carbonyl)amino]acetyl]amino]-3-[[1-(2-hydroxyethyl)pyridin-4-id-4-yl]sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Molecular Mass 683.777 g·mol−1
Heat of Formation -704.7 ± 16.7 kJ·mol−1
Dipole Moment 6.41 ± 1.08 D
Volume 719.08 Å 3
Surface Area 600.82 Å 2
Point Group Symmetry C1
InChIKey NRHJTCQXBIEKIC-IECBHUPTSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N