Isochlortetracycline

cas: 514-53-4 — see every product listed under this CAS number, including other names

Isochlortetracycline (CAS 514-53-4) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 25mg, 5mg, 1mg, 2mg, 5 mg, 1 mg. Offered by: TRC, TargetMol, GLPBio, Biosynth.

brandTRC
catalog numberTRC-I790000-10MG
cas514-53-4
size10mg
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Available pack sizes

brand size price
TRC 10mg price on request
TRC 25mg price on request
TRC 5mg price on request
TargetMol 1mg 1096.64 Pln
TargetMol 5mg 3666.36 Pln
TargetMol 10mg 5811.80 Pln
GLPBio 1mg 784.26 Pln
GLPBio 10mg 2768.79 Pln
GLPBio 5mg 1860.77 Pln
Biosynth 1mg price on request
Biosynth 2mg price on request
Biosynth 5mg price on request
Biosynth 10mg price on request
Biosynth 25mg price on request
MedChemExpress 5 mg 2325.90 Pln
MedChemExpress 1 mg 793.38 Pln

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

(4S,4aS,6S,8aR)-6-[(1S)-7-chloro-4-hydroxy-1-methyl-3-oxo-2-benzofuran-1-yl]-4-(dimethylamino)-1,8a-dihydroxy-3,8-dioxo-4a,5,6,7-tetrahydro-4H-naphthalene-2-carboxamide (CAS 514-53-4) is a chemical compound with the molecular formula C22H23ClN2O8 and a molecular weight of 478.9 g/mol. IUPAC name: (4S,4aS,6S,8aR)-6-[(1S)-7-chloro-4-hydroxy-1-methyl-3-oxo-2-benzofuran-1-yl]-4-(dimethylamino)-1,8a-dihydroxy-3,8-dioxo-4a,5,6,7-tetrahydro-4H-naphthalene-2-carboxamide. InChIKey: ZDCFZNSICAQKSV-AXVXPIMKSA-N.

Identity
Molecular formulaC22H23ClN2O8
Molecular weight478.9 g/mol
IUPAC name(4S,4aS,6S,8aR)-6-[(1S)-7-chloro-4-hydroxy-1-methyl-3-oxo-2-benzofuran-1-yl]-4-(dimethylamino)-1,8a-dihydroxy-3,8-dioxo-4a,5,6,7-tetrahydro-4H-naphthalene-2-carboxamide
InChIKeyZDCFZNSICAQKSV-AXVXPIMKSA-N
SMILESC[C@@]1(C2=C(C=CC(=C2C(=O)O1)O)Cl)[C@H]3C[C@H]4[C@@H](C(=O)C(=C([C@]4(C(=O)C3)O)O)C(=O)N)N(C)C

Computed by PubChem (NCBI)

Synonyms: Isochlortetracycline, Isoaureomycin, 7-Chloroisotetracycline, Isochlortetracyclinehydrochloride, iso-chlortetracycline, orb1692099
Related forms of this compound
(4S,4aS,6S,8aR)-6-[(1R)-7-chloro-4-hydroxy-1-methyl-3-oxo-2-benzofuran-1-yl]-4-(dimethylamino)-1,8a-dihydroxy-3,8-dioxo-4a,5,6,7-tetrahydro-4H-naphthalene-2-carboxamide C22H23ClN2O8
Isomers (same molecular formula)
(4S,4aS,5aS,6S,12aR)-7-chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide C22H23ClN2O8
(4S,4aR,5R,12aR)-4-(dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide;hydrochloride C22H23ClN2O8
(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 C22H23ClN2O8
(4R,4aS,5aS,6S,12aR)-7-chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide C22H23ClN2O8