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Doxycycline hydrate structure, CAS 564-25-0

Doxycycline hydrate

CAS Number564-25-0

SynonymsMonodox; azudoxat; Doxycen; MFCD02682958; gs-3065; Ronaxan; doxocycline; doryx; Unidox; doxitard; Doxycycline; spanor; Doxinyl; EINECS 209-271-1

Molecular FormulaC22H24O8N2

Molecular Weight444.44

Purity98%

Density1.6±0.1 g/cm3

Boiling Point685.2±55.0 °C at 760 mmHg

Melting Point206-209ºC

Flash Point

Appearanceyellow crystal powder

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-9010247 Purity: 98%
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Quality Control of [ 564-25-0 ] Purity: 98% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number564-25-0
Catalog No.2A-9010247
Chinese Name强力霉素
SynonymsMonodox; azudoxat; Doxycen; MFCD02682958; gs-3065; Ronaxan; doxocycline; doryx; Unidox; doxitard; Doxycycline; spanor; Doxinyl; EINECS 209-271-1
Molecular FormulaC22H24O8N2
Molecular Weight444.44
Purity98
Density1.6±0.1 g/cm3
Boiling Point685.2±55.0 °C at 760 mmHg
Melting Point206-209ºC
Appearanceyellow crystal powder
Storage Condition2-8C
ApplicationDoxycycline is a tetracycline antibiotic, an orally available, broad-spectrum metalloproteinase (MMP) inhibitor with antibacterial activity.
HTC3004909090
MDL NumberMFCD00800994
SMILESCC1c2cccc(O)c2C(O)=C2C(=O)C3(O)C(O)=C(C(N)=O)C(=O)C(N(C)C)C3C(O)C21
InChIInChI=1S/C22H24N2O8.ClH.2H2O/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;2*1H2/b21-13-;;;/t7-,10+,14+,15-,17-,22-;;;/m0.../s1
InChI KeySGKRLCUYIXIAHR-AKNGSSGZSA-N
MSDSmsds/10247_1_564_25_0.pdf
Use ofDoxycycline, an antibiotic, is an orally active and broad-spectrum metalloproteinase (MMP) inhibitor[1]. Properties Name doxycycline Synonym More Synonyms Doxycycline Biological Activity Description Doxycycline, an antibiotic, is an orally active and broad-spectrum metalloproteinase (MMP) inhibitor[1]. Related Catalog Research Areas >> Infection Signaling Pathways >> Metabolic Enzyme/Protease >> MMP References [1]. Briest W, et al. Doxycycline ameliorates the susceptibility to aortic lesions in a mouse model for the vascular type of Ehlers-Danlos syndrome. J Pharmacol Exp Ther. 2011 Jun;337(3):621-7. [2]. Luger AL, et al. Doxycycline Impairs Mitochondrial Function and Protects Human Glioma Cells from Hypoxia-Induced Cell Death: Implications of Using Tet-Inducible Systems. Int J Mol Sci. 2018 May 17;19(5). Chemical & Physical Properties Molecular Formula C22H24N2O8 Exact Mass 444.153259 PSA 181.62000 Index of Refraction 1.737 InChIKey SGKRLCUYIXIAHR-AKNGSSGZSA-N Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : 2-Naphthacenecarboxamide, 4-alpha-S-(dimethylamino)-1,4,4a-alpha-5,5a-alpha,6,1 1,12a- octahydro-3,5-alpha,10,12,12a-alpha-pentahydroxy-6-al pha-methyl-1,11-dioxo- CAS REGISTRY NUMBER : LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C22-H24-N2-O8 MOLECULAR WEIGHT : WISWESSER LINE NOTATION : HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : TDLo - Lowest published toxic dose ROUTE OF EXPOSURE : SPECIES OBSERVED : Human - woman DOSE/DURATION : TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Mammal - dog DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Mammal - dog DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value TYPE OF TEST : TDLo - Lowest published toxic dose ROUTE OF EXPOSURE : SEX/DURATION : female 2 day(s) after conception TOXIC EFFECTS : Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus) MUTATION DATA TYPE OF TEST : DNA inhibition TEST SYSTEM : Human Lymphocyte DOSE/DURATION : REFERENCE : Safety Information HS Code 3004909090 Synthetic Route Total: 1 Page Metacycline hyd... CAS#:3963-95-9 Doxycycline CAS#:564-25-0 epi-Doxycycline CAS#:3219-99-6 Literature: Tetrahedron Letters, , vol. 34, # 9 p. 1471 - 1474 doxycycline hyd... CAS#:10592-13-9 Doxycycline CAS#:564-25-0 Literature: CrystEngComm, , vol. 14, # 7 p. 2532 - 2540 Precursor & DownStream Precursor 2 CAS#:3963-95-9 Metacycline hyd... CAS#:10592-13-9 doxycycline hyd... DownStream 2 CAS#:6543-77-7 4-Epidoxycycline CAS#:10592-13-9 doxycycline hyd...
Transport InfoProduct Name: Doxycycline
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