4a-Hydroxy-9-methoxy-3-methyl-2,3,4,4a,5,6-hexahydro-1H-4,12-methano(1)benzofuro(3,2-e)isoquinolin-7(7aH)-one

HCID 4635CAS 850-50-0
子结构检索查找相似结构

基本信息

标准SMILES
COc1ccc2c3c1OC1C(=O)CCC4(O)C(C2)N(C)CCC314
InChIKey
BRUQQQPBMZOVGD-UHFFFAOYSA-N
分子式
C18H21NO4
平均分子量
315.4 g/mol
单同位素质量
315.14705815

概述

See also: Oxycodone (annotation moved to); Percocet (annotation moved to); Oxycodone Hydrochloride (annotation moved to) ... View More ...

名称与标识

首选名称
4a-Hydroxy-9-methoxy-3-methyl-2,3,4,4a,5,6-hexahydro-1H-4,12-methano(1)benzofuro(3,2-e)isoquinolin-7(7aH)-one
IUPAC
4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one

名称与别名

DTXSID40859094850-50-04a-Hydroxy-9-methoxy-3-methyl-2,3,4,4a,5,6-hexahydro-1H-4,12-methano(1)benzofuro(3,2-e)isoquinolin-7(7aH)-one4a-Hydroxy-9-methoxy-3-methyl-2,3,4,4a,5,6-hexahydro-1H-4,12-methano[1]benzofuro[3,2-e]isoquinolin-7(7aH)-oneRefChem:1071740DTXCID40204323OxiconeMorphinan-6-one, 4,5.alpha.-epoxy-14-hydroxy-3-methoxy-17-methyl-Tekodin (free base)4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-oneNSC 19043Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-17-methyl-, (5.alpha.)-
展开更多名称
Eucodal (Salt/Mix)Tecodin (Salt/Mix)Dinarkon (Salt/Mix)col-0034,5.alpha.-Epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-oneSCHEMBL10064505BRUQQQPBMZOVGD-UHFFFAOYSA-NCGA47791

数据库标识

CAS
850-50-0
PubChem CID
4635
DTXSID
DTXSID40859094
Nikkaji
J23.936D

性质

结构计算性质

XLogP
1.2
极性表面积
59 Ų
氢键供体
1
氢键受体
5
可旋转键
1
重原子
23

实验与物化性质

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相关反应

3 条
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关联笔记

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