Products 94088-85-4
CAS 94088-85-4 is the registry number for Doxycycline (calcium). Offered by: MedChemExpress. Available pack sizes: Get quote.
Dicalcium;(4S,4aR,5S,5aR,6R,12aR)-2-carbamoyl-4-(dimethylamino)-12a-hydroxy-6-methyl-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-1,5,10,11-tetrolate (CAS 94088-85-4) is a chemical compound with the molecular formula C22H20Ca2N2O8 and a molecular weight of 520.6 g/mol. IUPAC name: dicalcium;(4S,4aR,5S,5aR,6R,12aR)-2-carbamoyl-4-(dimethylamino)-12a-hydroxy-6-methyl-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-1,5,10,11-tetrolate. InChIKey: ZIHZIEZHQRIBEL-QFWOMMJSSA-K.
| Molecular formula | C22H20Ca2N2O8 |
|---|---|
| Molecular weight | 520.6 g/mol |
| IUPAC name | dicalcium;(4S,4aR,5S,5aR,6R,12aR)-2-carbamoyl-4-(dimethylamino)-12a-hydroxy-6-methyl-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-1,5,10,11-tetrolate |
| InChIKey | ZIHZIEZHQRIBEL-QFWOMMJSSA-K |
| SMILES | C[C@@H]1[C@H]2[C@@H]([C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4[O-])[O-])O)[O-])C(=O)N)N(C)C)[O-].[Ca+2].[Ca+2] |
Computed by PubChem (NCBI)
Synonyms:
orb1982002