1. Primary Information
| English name: | Methacycline hydrochloride |
| CAS No.: | 3963-95-9 |
| Molecular formula: | C22H23ClN2O8 |
| Molecular weight: | 478.9 g/mol |
| SMILES: | CN(C)C1C2C(C3C(=C)C4=C(C(=CC=C4)O)C(=C3C(=O)C2(C(=C(C1=O)C(=O)N)O)O)O)O.Cl |
| Structural class: | |
| Other identifiers: |
Lysocline Metacycline Methacycline Methacycline Monohydrochloride Methyleneoxytetracycline |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 100mg | HPLC≥99% | 768 | -20℃ | in stock | - |
| Kehua Intelligence | 100mg | 98% | 24 | -20℃ | in stock | - |
| Kehua Intelligence | 500mg | 98% | 40 | -20℃ | in stock | - |
| Kehua Intelligence | 1g | 98% | 52 | -20℃ | in stock | - |
| Kehua Intelligence | 5g | 98% | 160 | -20℃ | in stock | - |
| Kehua Intelligence | 25g | 98% | 480 | -20℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
(4S,4aR,5S,5aR,12aR)-4-(dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methylidene-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide;hydrochloride
4.2 InChI
InChI=1S/C22H22N2O8.ClH/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29;/h4-6,10,14-15,17,25-27,30,32H,1H2,2-3H3,(H2,23,31);1H/t10-,14-,15+,17+,22+;/m1./s1
4.3 InChIKey
VXPSARQTYDZXAO-CCHMMTNSSA-N
4.4 Canonical SMILES
CN(C)C1C2C(C3C(=C)C4=C(C(=CC=C4)O)C(=C3C(=O)C2(C(=C(C1=O)C(=O)N)O)O)O)O.Cl
4.5 Isomeric SMILES
CN(C)[C@H]1[C@@H]2[C@H]([C@@H]3C(=C)C4=C(C(=CC=C4)O)C(=C3C(=O)[C@@]2(C(=C(C1=O)C(=O)N)O)O)O)O.Cl
