[2S-(2alpha,5alpha,6beta)]-3,3-dimethyl-7-oxo-6-(phenoxyacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4-oxide (CAS 4888-90-8) — formula C16H18N2O6S, molecular weight 366.4; category organic chemicals.
| CAS Number | 4888-90-8 |
|---|---|
| Molecular Formula | C16H18N2O6S |
| Molecular Weight | 366.4 |
| LogP | 0.8 |
| Category | Organic Chemicals |
[2S-(2alpha,5alpha,6beta)]-3,3-dimethyl-7-oxo-6-(phenoxyacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4-oxide is a carbon-based organic compound with CAS registry number 4888-90-8 and molecular formula C16H18N2O6S (molecular weight 366.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4888-90-8
Its molecular formula C16H18N2O6S comprises 16 C, 18 H, 2 N, 6 O, 1 S atoms.
Also known as: [2S-(2alpha,5alpha,6beta)]-3,3-dimethyl-7-oxo-6-(phenoxyacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4-oxide · [2S-(2alpha,5alpha,6beta)]-3,3-二甲基-7-氧代-6-(苯氧基乙酰氨基)-4-硫杂-1-氮杂双环[3.2.0]庚烷-2-羧酸 4-氧化物
Category: organic chemicals
The CAS registry number of [2S-(2alpha,5alpha,6beta)]-3,3-dimethyl-7-oxo-6-(phenoxyacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4-oxide is 4888-90-8.
Molecular formula C16H18N2O6S, molecular weight 366.4.
It is also registered under: [2S-(2alpha,5alpha,6beta)]-3,3-dimethyl-7-oxo-6-(phenoxyacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4-oxide, [2S-(2alpha,5alpha,6beta)]-3,3-二甲基-7-氧代-6-(苯氧基乙酰氨基)-4-硫杂-1-氮杂双环[3.2.0]庚烷-2-羧酸 4-氧化物.
Category: Organic Chemicals.
Independent reference data for [2S-(2alpha,5alpha,6beta)]-3,3-dimethyl-7-oxo-6-(phenoxyacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4-oxide (CAS 4888-90-8), compiled from public chemistry databases.
| CAS 号 | 4888-90-8 |
|---|---|
| PubChem CID | 107602 |
| 分子式 | C16H18N2O6S |
| IUPAC 名称 | (2S,5R,6R)-3,3-dimethyl-4,7-dioxo-6-[(2-phenoxyacetyl)amino]-4λ4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid |
| UNII（FDA） | 8292WCQ5MA |
| Molecular Weight | 366.4 |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 366.08855747 |
| Monoisotopic Mass | 366.08855747 |
| Topological Polar Surface Area | 132 |
| Heavy Atom Count | 25 |
Penicillin V sulfoxide; 4888-90-8; 8292WCQ5MA; RefChem:170914; 225-507-6; Penicillin V beta-sulfoxide; Penicillin V alpha-sulfoxide; Penicillin Impurity 5; 0IE0RLU58F; Penicillin V sulfoxide, (R)-; Penicillin V sulfoxide, (S)-; Z848SM3L6R; Phenoxymethylpenicillin R-sulfoxide; 33069-20-4; 33069-21-5; EINECS 225-507-6
[2S-(2alpha,5alpha,6beta)]-3,3-二甲基-7-氧代-6-(苯氧基乙酰氨基)-4-硫杂-1-氮杂双环[3.2.0]庚烷-2-羧酸 4-氧化物 · CAS 4888-90-8 · C16H18N2O6S. UNII 8292WCQ5MA.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: [2S-(2alpha,5alpha,6beta)]-3,3-二甲基-7-氧代-6-(苯氧基乙酰氨基)-4-硫杂-1-氮杂双环[3.2.0]庚烷-2-羧酸 4-氧化物