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Carmoterol

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Identification

Summary

Carmoterol is a long acting beta-2 agonist indicated in the treatment of COPD, asthma, and chronic bronchitis.

Generic Name
Carmoterol
DrugBank Accession Number
DB15784
Background

Not Available

Type
Small Molecule
Groups
Experimental
Structure
3D
Similar Structures
Weight
Average: 368.433
Monoisotopic: 368.173607261
Chemical Formula
C21H24N2O4
Synonyms
  • Carmoterol
  • Quinoterol
External IDs
  • CHF 4226
  • CHF-4226
  • TA-2005
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Pharmacology

Indication

Not Available

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Associated Conditions
Indication TypeIndicationCombined Product DetailsApproval LevelAge GroupPatient CharacteristicsDose Form
Used in combination to manageAsthmaCombination Product in combination with: Mometasone furoate (DB14512)•••••••••••••••••
Used in combination for symptomatic treatment ofAsthmaCombination Product in combination with: Budesonide (DB01222)•••••••••••••••••••• ••••••
Adjunct therapy in management ofAsthma••••••••••••••••••••••••• ••••••
Used in combination to manageBronchoconstrictionCombination Product in combination with: Tiotropium (DB01409)•••••••••••••••••• •••••••••••••
Used in combination to manageChronic bronchitisCombination Product in combination with: Tiotropium (DB01409)•••••••••••••••••• •••••••••••••
Contraindications & Blackbox Warnings
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Pharmacodynamics

Not Available

Mechanism of action
TargetActionsOrganism
ABeta-2 adrenergic receptor
agonist
Humans
Absorption

Not Available

Volume of distribution

Not Available

Protein binding

Not Available

Metabolism
Not Available
Route of elimination

Not Available

Half-life

Not Available

Clearance

Not Available

Adverse Effects
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Toxicity

Not Available

Pathways
Not Available
Pharmacogenomic Effects/ADRs
Not Available
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Interactions

Drug Interactions
This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.
Not Available
Food Interactions
Not Available

Products

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Mixture Products
NameIngredientsDosageRouteLabellerMarketing StartMarketing EndRegionImage
LUXNID 2/200 MCG INHALASYON IÇIN TOZ IÇEREN BLISTER,60 DOZCarmoterol (2 mcg) + Ciclesonide (200 mcg)PowderRespiratory (inhalation)NEUTEC İNHALER İLAÇ SAN. VE TİC. A.Ş.2014-02-052022-11-19Turkey flag
LUXNID 2/200 MCG INHALASYON IÇIN TOZ IÇEREN KAPSÜL,120 KAPSÜLCarmoterol (2 mcg) + Ciclesonide (200 mcg)PowderRespiratory (inhalation)NEUTEC İNHALER İLAÇ SAN. VE TİC. A.Ş.2014-02-082022-11-19Turkey flag
LUXNID 2/200 MCG INHALASYON IÇIN TOZ IÇIEREN KAPSÜL,60 KAPSÜLCarmoterol (2 mcg) + Ciclesonide (200 mcg)PowderRespiratory (inhalation)NEUTEC İNHALER İLAÇ SAN. VE TİC. A.Ş.2014-02-082022-11-19Turkey flag
LUXNID 2/400 MCG INHALASYON IÇIN TOZ IÇEREN BLISTER ,60 DOZCarmoterol (2 mcg) + Ciclesonide (400 mcg)PowderRespiratory (inhalation)NEUTEC İNHALER İLAÇ SAN. VE TİC. A.Ş.2014-02-052022-11-19Turkey flag
LUXNID 2/400 MCG INHALASYON IÇIN TOZ IÇEREN KAPSÜL,120 KAPSÜLCarmoterol (2 mcg) + Ciclesonide (400 mcg)PowderRespiratory (inhalation)NEUTEC İNHALER İLAÇ SAN. VE TİC. A.Ş.2014-02-082022-11-19Turkey flag

Categories

Drug Categories
Classification
Not classified
Affected organisms
Not Available

Chemical Identifiers

UNII
9810NUL4D1
CAS number
147568-66-9
InChI Key
IHOXNOQMRZISPV-YJYMSZOUSA-N
InChI
InChI=1S/C21H24N2O4/c1-13(11-14-3-5-15(27-2)6-4-14)22-12-19(25)16-7-9-18(24)21-17(16)8-10-20(26)23-21/h3-10,13,19,22,24-25H,11-12H2,1-2H3,(H,23,26)/t13-,19+/m1/s1
IUPAC Name
8-hydroxy-5-[(1R)-1-hydroxy-2-{[(2R)-1-(4-methoxyphenyl)propan-2-yl]amino}ethyl]-1,2-dihydroquinolin-2-one
SMILES
COC1=CC=C(C[C@@H](C)NC[C@H](O)C2=CC=C(O)C3=C2C=CC(=O)N3)C=C1

References

General References
  1. TITCK Product Information: Luxnid (carmoterol hydrochloride/ciclesonide) powder for inhalation [Link]
  2. TITCK Product Information: ROPITAL (carmoterol and tiotropium) powder for inhalation [Link]
ChemSpider
57545
ChEMBL
CHEMBL1094785
ZINC
ZINC000034853956
PDBe Ligand
WHJ
Wikipedia
Carmoterol
PDB Entries
2y02

Clinical Trials

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PhaseStatusPurposeConditionsCountStart DateWhy Stopped100+ additional columns
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2CompletedTreatmentChronic Obstructive Pulmonary Disease (COPD)3somestatusstop reasonjust information to hide
1CompletedTreatmentChronic Obstructive Pulmonary Disease (COPD)1somestatusstop reasonjust information to hide

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage Forms
FormRouteStrength
PowderRespiratory (inhalation)1 mcg
PowderRespiratory (inhalation)2 mcg
PowderRespiratory (inhalation)4 mcg
PowderRespiratory (inhalation)
Capsule; powderRespiratory (inhalation)
Prices
Not Available
Patents
Not Available

Properties

State
Not Available
Experimental Properties
Not Available
Predicted Properties
PropertyValueSource
Water Solubility0.0188 mg/mLALOGPS
logP1.95ALOGPS
logP1.49Chemaxon
logS-4.3ALOGPS
pKa (Strongest Acidic)8.52Chemaxon
pKa (Strongest Basic)9.76Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count5Chemaxon
Hydrogen Donor Count4Chemaxon
Polar Surface Area90.82 Å2Chemaxon
Rotatable Bond Count7Chemaxon
Refractivity106.72 m3·mol-1Chemaxon
Polarizability39.77 Å3Chemaxon
Number of Rings3Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleYesChemaxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
SpectrumSpectrum TypeSplash Key
Predicted MS/MS Spectrum - 10V, Positive (Annotated)Predicted LC-MS/MSsplash10-014i-0629000000-f0cd211092217acb1714
Predicted MS/MS Spectrum - 10V, Negative (Annotated)Predicted LC-MS/MSsplash10-00lj-0917000000-042f317e81e0a61f974f
Predicted MS/MS Spectrum - 20V, Negative (Annotated)Predicted LC-MS/MSsplash10-01t9-2593000000-8966834811d5816d3521
Predicted MS/MS Spectrum - 20V, Positive (Annotated)Predicted LC-MS/MSsplash10-01b9-0954000000-373298dbe2b6b7d3978d
Predicted MS/MS Spectrum - 40V, Negative (Annotated)Predicted LC-MS/MSsplash10-0l0w-4926000000-9155cecf0b12bab70e1c
Predicted MS/MS Spectrum - 40V, Positive (Annotated)Predicted LC-MS/MSsplash10-01s9-0913000000-aa6eb8e08bbd5d59fe9e
Predicted 1H NMR Spectrum1D NMRNot Applicable
Predicted 13C NMR Spectrum1D NMRNot Applicable
Chromatographic Properties
Collision Cross Sections (CCS)
AdductCCS Value (Å2)Source typeSource
[M-H]-186.18327
predicted
DeepCCS 1.0 (2019)
[M+H]+188.57884
predicted
DeepCCS 1.0 (2019)
[M+Na]+194.49138
predicted
DeepCCS 1.0 (2019)

Targets

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Details1. Beta-2 adrenergic receptor
Kind
Protein
Organism
Humans
Pharmacological action
Yes
Actions
Agonist
General Function
Beta-adrenergic receptors mediate the catecholamine-induced activation of adenylate cyclase through the action of G proteins. The beta-2-adrenergic receptor binds epinephrine with an approximately 30-fold greater affinity than it does norepinephrine
Specific Function
adenylate cyclase binding
Gene Name
ADRB2
Uniprot ID
P07550
Uniprot Name
Beta-2 adrenergic receptor
Molecular Weight
46458.32 Da
References
  1. Zhou Y, Zhang Y, Zhao D, Yu X, Shen X, Zhou Y, Wang S, Qiu Y, Chen Y, Zhu F: TTD: Therapeutic Target Database describing target druggability information. Nucleic Acids Res. 2024 Jan 5;52(D1):D1465-D1477. doi: 10.1093/nar/gkad751. [Article]

Drug created at August 24, 2020 13:53 / Updated at August 26, 2024 19:23