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H2OCH3(R)(R)(S)OH(R)(S)NCH3H3CONH2OHO(S)OHOOHOH(Z)

CAS RN 17086-28-1

IUPAC Nombre: (2Z,4S,4aR,5S,5aR,6R,12aS)-2-[amino(hydroxy)methylidene]-4-(dimethylamino)-5,10,11,12a-tetrahydroxy-6-methyl-1,2,3,4,4a,5,5a,6,12,12a-decahydrotetracene-1,3,12-trione hydrate
Sinónimos: doxytetracycline hydrate
Peso molecular (g/mol): 462.46
Fórmula molecular: C22H26N2O9
InChi Key: ADAURKPGCFUREH-UQVCFKGQSA-N
SMILES: O.C[C@@H]1[C@H]2[C@H](O)[C@H]3[C@H](N(C)C)C(=O)\C(=C(/N)O)C(=O)[C@@]3(O)C(=O)C2=C(O)C2=C(O)C=CC=C12
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Doxycycline monohydrate, Thermo Scientific™

CAS: 17086-28-1 Fórmula molecular: C22H26N2O9 Peso molecular (g/mol): 462.455 Número MDL: MFCD02682958 Clave InChI: FZKWRPSUNUOXKJ-CVHRZJFOSA-N PubChem CID: 54684461 Nombre IUPAC: (4S,4aR,5S,5aR,6R,12aR)-4-(dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;hydrate SMILES: CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.O

Clave InChI FZKWRPSUNUOXKJ-CVHRZJFOSA-N
PubChem CID 54684461
Fórmula molecular C22H26N2O9
CAS 17086-28-1
Peso molecular (g/mol) 462.455
Número MDL MFCD02682958
SMILES CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.O
Nombre IUPAC (4S,4aR,5S,5aR,6R,12aR)-4-(dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;hydrate
2

Thermo Scientific Chemicals Monohidrato de doxiciclina, 97 %

CAS: 17086-28-1 Fórmula molecular: C22H24N2O8·H2O Peso molecular (g/mol): 462.45 Clave InChI: FZKWRPSUNUOXKJ-CVHRZJFOSA-N Sinónimo: doxycycline monohydrate,doxycycline hydrate,adoxa,doxycycline hcl,4-dimethylamino-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide monohydrate,adoxa pak,4s,4ar,5s,5ar,6r,12as-4-dimethylamino-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrate,vibramycin-d,doxycycline usp,monodox tn PubChem CID: 54684461 Nombre IUPAC: (4S,4aR,5S,5aR,6R,12aR)-4-(dimetilamino)-1,5,10,11,12a-pentahidroxi-6-metil-3,12-dioxo-4a,5,5a,6-tetrahidro-4H-tetraceno-2-carboxamida; hidrato SMILES: CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.O

Sinónimo doxycycline monohydrate,doxycycline hydrate,adoxa,doxycycline hcl,4-dimethylamino-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide monohydrate,adoxa pak,4s,4ar,5s,5ar,6r,12as-4-dimethylamino-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrate,vibramycin-d,doxycycline usp,monodox tn
Clave InChI FZKWRPSUNUOXKJ-CVHRZJFOSA-N
PubChem CID 54684461
Fórmula molecular C22H24N2O8·H2O
CAS 17086-28-1
Peso molecular (g/mol) 462.45
SMILES CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.O
Nombre IUPAC (4S,4aR,5S,5aR,6R,12aR)-4-(dimetilamino)-1,5,10,11,12a-pentahidroxi-6-metil-3,12-dioxo-4a,5,5a,6-tetrahidro-4H-tetraceno-2-carboxamida; hidrato