1. Primary Information
| English name: | Amoxicillin Trihydrate |
| CAS No.: | 61336-70-7 |
| Molecular formula: | C16H25N3O8S |
| Molecular weight: | 419.5 g/mol |
| SMILES: | CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)C(=O)O)C.O.O.O |
| Structural class: | |
| Other identifiers: |
Actimoxi Amoxicillin Amoxicillin Anhydrous Amoxicillin monopotassium salt Amoxicillin monosodium salt |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 100mg | HPLC≥95% | 240 | 2-8℃ | in stock | - |
| Kehua Intelligence | 1g | HPLC≥95% | 800 | 2-8℃ | in stock | - |
| Kehua Intelligence | 1ml | 100μg/ml in methanol | 80 | 2-8℃ | in stock | - |
| Kehua Intelligence | 1ml | 100μg/ml in H2O | 80 | 2-8℃ | in stock | - |
| Kehua Intelligence | 5g | USP级，95% | 48 | 2-8℃ | in stock | - |
| Kehua Intelligence | 25g | USP级，95% | 144 | 2-8℃ | in stock | - |
| Kehua Intelligence | 100g | USP级，95% | 384 | 2-8℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
(2S,5R,6R)-6-[[(2R)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;trihydrate
4.2 InChI
InChI=1S/C16H19N3O5S.3H2O/c1-16(2)11(15(23)24)19-13(22)10(14(19)25-16)18-12(21)9(17)7-3-5-8(20)6-4-7;;;/h3-6,9-11,14,20H,17H2,1-2H3,(H,18,21)(H,23,24);3*1H2/t9-,10-,11+,14-;;;/m1.../s1
4.3 InChIKey
MQXQVCLAUDMCEF-CWLIKTDRSA-N
4.4 Canonical SMILES
CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)C(=O)O)C.O.O.O
4.5 Isomeric SMILES
CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=C(C=C3)O)N)C(=O)O)C.O.O.O
