Preferred Name

doxycycline

Synonyms

(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

(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

doxiciclina

doxycycline

doxycycline (anhydrous)

5-hydroxy-alpha-6-deoxytetracycline

6alpha-deoxy-5-oxytetracycline

doxycyclinum

Doxycyclin

Jenacyclin

Supracyclin

Vibramycin

Doxycycline

Definitions

Tetracycline in which the 5beta-hydrogen is replaced by a hydroxy group, while the 6alpha-hydroxy group is replaced by hydrogen. A semi-synthetic tetracycline antibiotic, it is used to inhibit bacterial protein synthesis and treat non-gonococcal urethritis and cervicitis, exacerbations of bronchitis in patients with chronic obstructive pulmonary disease (COPD), and adult periodontitis.

ID

http://purl.obolibrary.org/obo/CHEBI_50845

charge

0

database_cross_reference

Drug_Central:961

Patent:US3200149

KEGG:C06973

VSDB:1840

Beilstein:3041790

PDBeChem:DXT

CAS:564-25-0

DrugBank:DB00254

PMID:1650428

Patent:US3019260

Reaxys:3041790

KNApSAcK:C00017127

Wikipedia:Doxycycline

KEGG:D07876

definition

Tetracycline in which the 5beta-hydrogen is replaced by a hydroxy group, while the 6alpha-hydroxy group is replaced by hydrogen. A semi-synthetic tetracycline antibiotic, it is used to inhibit bacterial protein synthesis and treat non-gonococcal urethritis and cervicitis, exacerbations of bronchitis in patients with chronic obstructive pulmonary disease (COPD), and adult periodontitis.

formula

C22H24N2O8

has role

http://purl.obolibrary.org/obo/CHEBI_36047

http://purl.obolibrary.org/obo/CHEBI_38068

has_alternative_id

CHEBI:4713

CHEBI:42135

has_exact_synonym

(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

Doxycycline

has_obo_namespace

chebi_ontology

has_related_synonym

(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

doxiciclina

doxycycline

doxycycline (anhydrous)

5-hydroxy-alpha-6-deoxytetracycline

6alpha-deoxy-5-oxytetracycline

doxycyclinum

Doxycyclin

Jenacyclin

Supracyclin

Vibramycin

id

CHEBI:50845

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C22H24N2O8/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/h4-7,10,14-15,17,25,27-29,32H,1-3H3,(H2,23,31)/t7-,10+,14+,15-,17-,22-/m0/s1

inchikey

JBIWCJUYHHGXTC-AKNGSSGZSA-N

label

doxycycline

mass

444.43464

monoisotopicmass

444.15327

notation

CHEBI:50845

prefLabel

doxycycline

smiles

[H][C@@]12[C@@H](C)c3cccc(O)c3C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]1([H])[C@H]2O

treeView

http://purl.obolibrary.org/obo/CHEBI_26895

subClassOf

http://purl.obolibrary.org/obo/CHEBI_26895

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