Basic information
- CAS
400827-55-6- Standard SMILES
CC(=O)[O-].CCO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(Sc3nc(-c4cc[n+](C)cc4)cs3)CS[C@H]12)c1nsc(NP(=O)(O)O)n1.O- InChIKey
KRWPPVCZNGQQHZ-IINIBMQSSA-N- Molecular formula
- C24H27N8O11PS4
- Average molar mass
- 762.8 g/mol
- Monoisotopic mass
- 762.0419754
Overview
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Names & identifiers
- Preferred name
- Ceftaroline fosamil acetic acid monohydrate
- IUPAC
- (6R,7R)-7-[[(2Z)-2-ethoxyimino-2-[5-(phosphonoamino)-1,2,4-thiadiazol-3-yl]acetyl]amino]-3-[[4-(1-methylpyridin-1-ium-4-yl)-1,3-thiazol-2-yl]sulfanyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;acetate;hydrate
- English name
- ceftaroline fosamil acetate monohydrate
- Molecular formula
- C22H22N8O8PS4.C2H3O2.H2O
- Molecular weight
- 762.76
Names & synonyms
Ceftaroline Fosamil hydrateCeftaroline fosamil acetic acid monohydrate866021-48-9Ceftaroline Fosamil Acetate [USAN]TAK 599 monoacetate monohydrateCeftarolineFosamilhydratePyridinium, 4-(2-(((6R,7R)-2-carboxy-7-(((2Z)-(ethoxyimino)(5- (phosphonoamino)-1,2,4-thiadiazol-3-yl)acetyl)amino)-8-oxo-5-thia-1- azabicyclo(4.2.0)oct-2-en-3-yl)thio)-4-thiazolyl)-1-methyl-, inner salt, monoacetate, monohydrateorb1982803SCHEMBL1690569HY-14737ACeftaroline fosamil (hydrate)(acetate)T74591
Show more names
TAK 599 acetate H2Oceftaroline fosamil acetate monohydrateCeftaroline fosamil acetate hydrate - Bio-X ?4-[2-[[(6R,7R)-2-carboxy-7-[[(2Z)-(ethoxyimino)[5-(phosphonoamino)-1,2,4-thiadiazol-3-yl]acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thio]-4-thiazolyl]-1-methylpyridinium acetate hydra4-[2-[[(6R,7R)-2-Carboxy-7-[[(2Z)-(ethoxyimino)[5-(phosphonoamino)-1,2,4-thiadiazol-3-yl]acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thio]-4-thiazolyl]-1-methylpyridinium acetate hydrate
Properties
Computed structural properties
- Topological polar surface area
- 369 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 20
- Rotatable bonds
- 11
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 1,240
Physicochemical properties
- FDA UNII
- 9 VXV1408Y · P9VXV1408Y
- Symbol(GHS)
- 8 · GHS08
- Signal word
- Danger
- Hazard statements
- 317 · H317-H334
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P261-P285-P304+P341-P342+P311-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS08
- Hazard statements
- H317-H334
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P261-P285-P304+P341-P342+P311-P501
Chemistry & industry
Applications
UsesCeftaroline fosamil hydrate is a potent cephalosporin antibiotic. Ceftaroline fosamil hydrateshows broad-spectrum activity against Gram-positive pathogens, including methicillin-resistant Staphylococcus aureus (MRSA) and multidrug-resistant Streptococcus pneumoniae, and common Gram-negative organisms. Ceftaroline fosamil hydrate has anti-infective activity, and can be used for the research of complicated skin and skin structure infections (cSSSIs) and community-acquired bacterial pneumonia (CABP)[1][2][3].
Suppliers27 total
石家庄感拓生物科技有限公司[email protected]
广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
韶关市启程生物科技有限公司18122215013 · [email protected]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
台州川旭医药科技有限公司[email protected] 15165038510 · [email protected]
上海博志研新药物技术有限公司+86（21）5895-0312 · [email protected]
铜陵恒优生物科技有限公司021-50426030 13856289449;13124863828 · [email protected]
湖北扬信医药科技有限公司07143299675 13092790750 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
济南晟齐医药科技有限公司0531-88892685 18660160628 · [email protected]
Related reactions
0 records
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Compound notes
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