(4R,5S,8Z)-8-(2-Amino-1,3-Thiazol-4-Yl)-1-[3-(1,5-Dihydroxy-4-Oxo-1,4-Dihydro-2-Pyridinyl)-1,2-Oxazol-5-Yl]-5-Formyl-11,11-Dimethyl-1,7-Dioxo-4-(Sulfoamino)-10-Oxa-2,6,9-Triazadodec-8-En-12-Oic Acid
Properties
Property | Value |
---|---|
Formula | C22H24N8O13S2 |
IUPAC Name | 2-[(z)-[1-(2-aminothiazol-4-yl)-2-[[(1s,2r)-3-[[3-(1,5-dihydroxy-4-oxo-piperidine-2,3,5,6-tetraid-2-yl)isoxazole-5-carbonyl]amino]-1-formyl-2-(sulfoamino)propyl]amino]-2-oxo-ethylidene]amino]oxy-2-methyl-propanoic acid |
Molecular Mass | 672.602 g·mol−1 |
Heat of Formation | 1314.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 19.59 ± 1.08 D |
Volume | 581.03 Å 3 |
Surface Area | 477.99 Å 2 |
HOMO Energy | -9.23 ± 0.55 eV |
LUMO Energy | -4.25 ± eV |
Point Group Symmetry | C1 |
InChIKey | OFOVQVNKWTUULV-NEEHKMPWSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C S O N |