aspoxicillin (CAS 63358-49-6) — formula C21H27N5O7S, molecular weight 493.5.
| CAS Number | 63358-49-6 |
|---|---|
| Molecular Formula | C21H27N5O7S |
| Molecular Weight | 493.5 |
| LogP | -3.4 |
aspoxicillin is a chemical compound with CAS registry number 63358-49-6 and molecular formula C21H27N5O7S (molecular weight 493.5).
CAS number: 63358-49-6
Its molecular formula C21H27N5O7S comprises 21 C, 27 H, 5 N, 7 O, 1 S atoms.
Also known as: aspoxicillin · 阿扑西林
The CAS registry number of aspoxicillin is 63358-49-6.
Molecular formula C21H27N5O7S, molecular weight 493.5.
It is also registered under: aspoxicillin, 阿扑西林.
Independent reference data for aspoxicillin (CAS 63358-49-6), compiled from public chemistry databases.
| CAS Registry Number | 63358-49-6 |
|---|---|
| PubChem CID | 71961 |
| Molecular formula | C21H27N5O7S |
| IUPAC name | (2S,5R,6R)-6-[[(2R)-2-[[(2R)-2-amino-4-(methylamino)-4-oxobutanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid |
| UNII (FDA) | 0745KNO26J |
| Molecular Weight | 493.5 |
|---|---|
| XLogP3 | -3.4 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 8 |
| Exact Mass | 493.16311939 |
| Monoisotopic Mass | 493.16311939 |
| Topological Polar Surface Area | 216 |
| Heavy Atom Count | 34 |
aspoxicillin; 63358-49-6; Aspoxicilina; Aspoxicilline; Doyle; Aspoxicillinum; DTXSID6046921; TA-058; 0745KNO26J; DTXCID4026921; RefChem:916399; J01CA19; N(4)-methyl-D-asparaginylamoxicillin; 634-698-9; Aspoxicillan; Doyle (TN)
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
aspoxicillin · CAS 63358-49-6 · C21H27N5O7S. UNII 0745KNO26J.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 阿扑西林