Noscapine Hydrochloride
Grundinformationen
- CAS
219533-73-0- Standard-SMILES
COc1ccc2c(c1OC)C(=O)O[C@@H]2[C@H]1c2c(cc3c(c2OC)OCO3)CCN1C.Cl- InChIKey
MFLVZFXCSKVCSH-URBRKQAFSA-N- Summenformel
- C22H23NO7.ClH
- Durchschnittliche Molmasse
- 449,9 g/mol
- Monoisotopische Masse
- 449,1241298
Überblick
Noscapine Hydrochloride is the orally available hydrochloride salt of the opioid agonist noscapine, a phthalideisoquinoline alkaloid derived from the opium poppy Papaver somniferum, with mild analgesic, antitussive, and potential antineoplastic activities. Noscapine binds to tubulin and alters its conformation, resulting in a disruption of the dynamics of microtubule assembly (by increasing the time that microtubules spend idle in a paused state) and subsequently, the inhibition of mitosis and tumor cell death. Unlike other tubulin inhibitors such as the taxanes and vinca alkaloids, noscapine does not affect microtubule polymerization.
Namen und Bezeichner
- Bevorzugter Name
- Noscapine Hydrochloride
- IUPAC
- (3S)-6,7-dimethoxy-3-[(5R)-4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3H-2-benzofuran-1-one;hydrochloride
Namen und Synonyme
Noscapine hydrochloride912-60-7Noscapine HClNoscapine (as hydrochloride)Narcotine hydrochlorideTTN62ITH9INSC-757235DTXSID6073239Noscapine hydrochloride anhydrousRefChem:166738DTXCID30487301(3H)Isobenzofuranone,6,7-dimethoxy-3-(5,6,7,8-tetrahydro-4-methoxy-6-methyl-1,3,-dioxolo(4,5-g)isoquinolin-5-yl)-hydrochloride
Weitere Namen anzeigen
213-014-9811-117-9Noscapine hydrchlorideNoscapine (hydrochloride)Noscapine hydrochloride hydrate1(3H)-Isobenzofuranone, 6,7-dimethoxy-3-[(5R)-5,6,7,8-tetrahydro-4-methoxy-6-methyl-1,3-dioxolo[4,5-g]isoquinolin-5-yl]-, hydrochloride (1:1), (3S)-Noscapine.HCl (Narcotine)C22H24ClNO7
Datenbank-Bezeichner
- CAS
219533-73-0、912-60-7- PubChem CID
- 9933439
- DTXSID
DTXSID6073239- ChEMBL
CHEMBL2106732- UNII
- TTN62ITH9I
- EC Number
- 213-014-9、811-117-9
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 75,7 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 8
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 31
- Formalladung
- 0
- Komplexität
- 647
Experimentelle und physikochemische Eigenschaften
Collision Cross Section193.4 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H302 (97.9%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 48 reports by companies from 4 notifications to the ECHA C&L Inventory.
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Gefahrenhinweise
Regulatory InformationChemical: 1(3H)-Isobenzofuranone, 6,7-dimethoxy-3-(5,6,7,8-tetrahydro-4-methoxy-6-methyl-1,3-dioxolo[4,5-g]isoquinolin-5-yl)-, hydrochloride, [S-(R*,S*)]-
Other Safety InformationIMAP assessments - 1(3H)-Isobenzofuranone, 6,7-dimethoxy-3-(5,6,7,8-tetrahydro-4-methoxy-6-methyl-1,3-dioxolo[4,5-g]isoquinolin-5-yl)-, hydrochloride, [S-(R*,S*)]-: Environment tier I assessment
Hazard Classes and Categories
Acute Tox. 4 (97.9%)
Acute Tox. 4 (100%)
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological ClassificationAgents that suppress cough. They act centrally on the medullary cough center. EXPECTORANTS, also used in the treatment of cough, act locally.
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