![2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, monohydrochloride, [4S-(4alpha,4aalpha,5alpha,5aalpha,6beta,12aalpha)]- structure, CAS 41411-66-9](/structures/180000/169895_2_41411_66_9.png)
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 41411-66-9 |
| Catalog No. | 2A-1169769 |
| Chinese Name | 6-差向强力霉素盐酸盐 |
| Synonyms | doxycycline 6-epimer hcl |
| Molecular Formula | C22H25ClN2O8 |
| Molecular Weight | 480.89600 |
| Purity | 98.00 |
| PubChem ID | 135249894 |
| SMILES | CC1c2cccc(O)c2C(O)=C2C(=O)C3(O)C(O)=C(C(N)=O)C(=O)C(N(C)C)C3C(O)C21.Cl |
| InChI | InChI=1S/C22H24N2O8.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;/h4-7,10,14-15,17,25-27,31-32H,23H2,1-3H3;1H/b21-13-; |
| InChI Key | PTNZGHXUZDHMIQ-PEHULTARSA-N |
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