Formula |
C16H17N3O5S |
IUPAC Name |
(6r,7r)-7-[[(2r)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
Molecular Mass |
363.388 g·mol−1 |
Heat of Formation |
-607.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.76 ± 1.08 D |
Volume |
405.4 Å 3 |
Surface Area |
338.89 Å 2 |
HOMO Energy |
-9.21 ± 0.55 eV |
LUMO Energy |
-0.74 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (6r,7r)-7-[[(2r)-2-amino-2-(4-hydroxyphenyl)-1-oxoethyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (6r,7r)-7-[[(2r)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (6r,7r)-7-[[(2r)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-8-keto-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (6r,7r)-7-[[(2r)-2-amino-2-(4-hydroxyphenyl)ethanoyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- (6r,7r)-7-{[(2r)-2-amino-2-(4-hydroxyphenyl)acetyl]amino}-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- bb_nc-1256
- bpbio1_000494
- cefadroxil (jp15)
- d00257
- sumacef
|
CAS Number(s) |
|
InChIKey |
BOEGTKLJZSQCCD-UEKVPHQBSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
S
C
O
N
|
|
|