Galanthamine N-Oxide

HCID 11748698
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基本情報

CAS
199014-26-1
標準SMILES
COc1ccc2c3c1O[C@H]1C[C@@H](O)C=C[C@@]31CC[N+](C)([O-])C2
InChIKey
LROQBKNDGTWXET-FVWDGWMTSA-N
分子式
C17H21NO4
平均分子量
303.35 g/mol
単同位体質量
303.14705815

名称と識別子

優先名称
Galanthamine N-Oxide
IUPAC
(1S,12S,14R)-9-methoxy-4-methyl-4-oxido-11-oxa-4-azoniatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-ol
英語名
LROQBKNDGTWXET-FVWDGWMTSA-N
分子式
C17H21NO4
分子量
303.35

名称と別名

Galanthamine N-OxideGalantamine N-OxideUNII-S6AF61T5WOS6AF61T5WO(1S,12S,14R)-9-methoxy-4-methyl-4-oxido-11-oxa-4-azoniatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-olDTXSID40173681GALANTAMINE METABOLITE M10GALANTHAMINE (RS)-N-OXIDE(4AS-(4A.ALPHA.,6.BETA.,8AR*))-4A,5,9,10,11,12-HEXAHYDRO-3-METHOXY-11-METHYL-6H-BENZOFURO(3A,3,2-EF)(2)BENZAZEPIN-6-OL, N-OXIDE6H-BENZOFURO(3A,3,2-EF)(2)BENZAZEPIN-6-OL, 4A,5,9,10,11,12-HEXAHYDRO-3-METHOXY-11-METHYL-, 11-OXIDE, (4AS,6R,8AS)-6H-BENZOFURO(3A,3,2-EF)(2)BENZAZEPIN-6-OL, 4A,5,9,10,11,12-HEXAHYDRO-3-METHOXY-11-METHYL-, 11-OXIDE, (4AS-(4A.ALPHA.,6.BETA.,8AR*))-(1S,12S,14R)-9-methoxy-4-methyl-4-oxido-11-oxa-4-azoniatetracyclo(8.6.1.01,12.06,17)heptadeca-6(17),7,9,15-tetraen-14-ol
名称をさらに表示
Galantamine Impurity 2Galantamine Impurity 5Galantamine EP impurityLROQBKNDGTWXET-FVWDGWMTSA-NPhenylgalantamine impurity 31Impurity H of galanthamine hydrobromide(4aS,6R,8aS)-4a,5,9,10,11,12-Hexahydro-3-methoxy-11-methyl-6H-benzofuro[3a,3,2-ef][2]benzazepin-6-ol 11-oxide6H-Benzofuro[3a,3,2-ef][2]benzazepin-6-ol, 4a,5,9,10,11,12-hexahydro-3-methoxy-11-methyl-, 11-oxide, (4aS,6R,8aS)-(4aS,6R,8aS)-6-hydroxy-3-methoxy-11-methyl-4a,5,9,10,11,12-hexahydro-6H-benzo[2,3]benzofuro[4,3-cd]azepine 11-oxide
RefChem:142153DTXCID2096172GALANTAMINE HYDROBROMIDE IMPURITY, 6.BETA.-HEXAHYDROGALANTAMINE-[USP IMPURITY]GALANTAMINE HYDROBROMIDE IMPURITY, 6BETA-HEXAHYDROGALANTAMINE-(USP IMPURITY)(4AS-(4AALPHA,6BETA,8AR*))-4A,5,9,10,11,12-HEXAHYDRO-3-METHOXY-11-METHYL-6H-BENZOFURO(3A,3,2-EF)(2)BENZAZEPIN-6-OL, N-OXIDE6H-BENZOFURO(3A,3,2-EF)(2)BENZAZEPIN-6-OL, 4A,5,9,10,11,12-HEXAHYDRO-3-METHOXY-11-METHYL-, 11-OXIDE, (4AS-(4AALPHA,6BETA,8AR*))-199014-26-1Nivalin-oxide

データベース識別子

CAS
199014-26-1
PubChem CID
11748698
DTXSID
DTXSID40173681
UNII
S6AF61T5WO
Nikkaji
J391.066K

物性

構造計算による物性

XLogP
1.3
極性表面積
56.8 Ų
水素結合供与体数
1
水素結合受容体数
4
回転可能結合数
1
重原子数
22

物理化学的性質

酸解離定数(Pka)
13.84 · 13.84±0.20(Predicted)
主な用途
医薬品低分子化合物

化学と産業

薬理情報

Metabolism/MetabolitesGalantamine N-oxide is a known human metabolite of galantamine.

応用分野

使用(4aS,6R,8aS)-4a,5,9,10,11,12-Hexahydro-3-methoxy-11-methyl-6H-benzofuro[3a,3,2-ef][2]benzazepin-6-ol 11-oxide is studied for its potential use as neuroprotective compounds from the bulbs of Lycoris radiata.

サプライヤー31 社

广州佳途科技股份有限公司81960175 18933936954 · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
深圳鼎邦化学品有限公司15616500668 · [email protected]
仙桃市丽昭医药科技有限公司18571672902 · [email protected]
南京望知星医药科技有限公司18569809817 · [email protected]

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