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莨菪碱 | 101-31-5

莨菪碱
L-Hyoscyamine
101-31-5
C17H23NO3
289.3694
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:莨菪碱结构式
莨菪碱MSDS
154417
莨菪碱价格
简介
L-Hyscyamine (Daturine) 是一种天然的植物托烷生物碱,是有效的,竞争性的毒蕈碱受体 (MR) 拮抗剂。L-Hyscyamine 是 Atropine (HY-B1205) 的左旋异构体。
名称和标识符
MDL MFCD00067306
InChIKey RKUNBYITZUJHSG-QXULXFAOSA-N
Inchi 1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15?,16-/m0/s1
SMILES O(C([C@@]([H])(C([H])([H])O[H])C1C([H])=C([H])C([H])=C([H])C=1[H])=O)C1([H])C([H])([H])[C@@]2([H])C([H])([H])C([H])([H])[C@@]([H])(C1([H])[H])N2C([H])([H])[H]
别名信息
- 中文别名 -
  • 莨菪碱
  • 天仙子碱
  • L-莨菪碱
  • 澳洲毒茄碱
  • 杜波辛
  • 菲沃斯碱
  • 菲沃斯素
  • 海沃辛
  • (-)-Hyoscyamine (-)-莨菪碱
  • (-)-莨菪碱
  • Hyoscyamine 莨菪碱 标准品
  • L-天仙子胺
  • 天仙子胺
  • (-)-莨菪碱,L-天仙子胺,L-天仙子碱
  • 7-[4-([11-联苯]-3-甲基)-1-哌嗪基]-5-氯-2(3H),苯并恶唑酮甲磺酸
  • 富马酸卢帕他定
  • 莨菪碱 标准品
  • 氢溴酸东莨菪碱杂质A(EP)
  • (8-甲基-8-氮杂双环[3.2.1]辛-3-基) (2S)-3-羟基-2-苯基丙酸酯
  • 莨菪胺
- 英文别名 -
  • L-Hyoscyamine
  • (-)-hyoscyamin
  • (-)-tropicaciesterwithtropine
  • (3(s)-endo)-leste
  • (S)-(-)-Hyoscyamine
  • [3(s)-endo]-leste
  • 1-Hyoscyamine
  • alpha-(hydroxymethyl)-benzeneaceticaci8-methyl-8-azabicyclo(3.2.1)oct-3-y
  • alpha-(hydroxymethyl)-benzeneaceticaci8-methyl-8-azabicyclo[3.2.1]oct-3-y
  • (-)-HYCOSAMINE
  • (2S)-(1R,5S)-8-Methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate
  • Daturine
  • Hyoscamine
  • Hyoscyamine
  • HYOSCYAMINE, L-(P)
  • (-)-HyoscyaMine
  • chlorhydratedescopolamine
  • SCOPINE TROPATE
  • SCOPINE TROPATE HYDROCHLORIDE
  • scopolamine HCl
  • ScopolamineSeries
  • L-Atropine
  • (8-Methyl-8-azabicyclo[3.2.1]octan-3-yl) (2S)-3-hydroxy-2-phenylpropanoate
  • AK38
  • APOA
  • L-(P)
  • Levsin
  • SEPSECS
  • Levsinex
  • MGC161491
  • Cystospaz
  • Duboisine
  • (R)-atropine
  • (+)-Atropine
  • (+)-HYOSCYAMINE
  • tropan-3alpha-yl (2R)-3-hydroxy-2-phenylpropanoate
  • (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl (2R)-3-hydroxy-2-phenylpropanoate
  • V3203SI72M
  • [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (2R)-3-hydroxy-2-phenylpropanoate
  • Prestwick2_000233
  • Prestwick1_000233
  • Prestwick0_000233
  • SPBio_002226
  • HMS1568P07
  • TNP00272
  • Atropine 1.
  • CHEBI:92712
  • RKUNBYITZUJHSG-FXUDXRNXSA-N
  • 912642-93-4
  • EINECS 202-933-0
  • (3beta)-Hyoscyamine
  • DTXSID80889335
  • Prestwick_273
  • Prestwick3_000233
  • l-Hyopscyamine
  • Q413762
  • (leo)-atropine
  • (1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl (2S)-3-hydroxy-2-phenylpropanoate
  • CHEBI:17486
  • (-)-Hyoscyamine
  • Hyoscyamine dried down 100 microg/mL
  • (-)-Hyoscyamin
  • HYOSCYAMINE [USP MONOGRAPH]
  • Atropine, (s)-
  • (2S)-3-hydroxy-2-phenylpropanoic acid [(5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] ester
  • HYOSCYAMINE [MART.]
  • Benzeneacetic acid, alpha-(hydroxymethyl)-, (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, (alphaS)-
  • Hyocyamine
  • HYOSCYAMINE [MI]
  • SCHEMBL1649244
  • SR-01000799139
  • NS00066992
  • (1R,5S)-8-METHYL-8-AZABICYCLO[3.2.1]OCT-3-YL (2R)-3-HYDROXY-2-PHENYLPROPANOATE
  • Hyosyne
  • F14785
  • l-Atropine
  • Levsinex SR
  • HYOSCYAMINUM [HPUS]
  • (S)-Atropine
  • Levsin SL
  • (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl (2S)-3-hydroxy-2-phenylpropanoate
  • Symax SL
  • HYOSCYAMINE [WHO-DD]
  • (1s,5r)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl (2s)-3-hydroxy-2-phenylpropanoate
  • (-)-Hycosamine
  • hyoscyamine
  • BDBM50497835
  • (3-exo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl (2S)-3-hydroxy-2-phenylpropanoate
  • CHEMBL1234973
  • UNII-PX44XO846X
  • [3(S)-endo]-a-(Hydroxymethyl)benzeneacetic acid 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester
  • SMR000718747
  • SCHEMBL249586
  • NSC-757064
  • Benzeneacetic acid, a-(hydroxymethyl)-, (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, (aS)-
  • PX44XO846X
  • [3(S)-endo]-alpha-(hydroxymethyl)benzeneacetic acid 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester
  • MLS002222193
  • C02046
  • Hyoscyamine, l-
  • HMS3712P07
  • Symax Duotab
  • Bellafoline
  • BRD-K40530731-001-02-5
  • L-Tropine tropate
  • MLS002154242
  • CCG-220233
  • L-TROPIC ACID ESTER WITH TROPINE
  • HSDB 3552
  • [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (2S)-3-hydroxy-2-phenylpropanoate
  • (-)-Atropine
  • L-Hyoscamine
  • (S)atropine
  • HMS2095P07
  • BRD-K40530731-001-11-6
  • Benzeneacetic acid, alpha-(hydroxymethyl)-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, (3(S)-endo)-
  • Hyoscyamine (L)
  • CHEMBL2449003
  • BPBio1_000337
  • 2arm
  • SCHEMBL41316
  • DTXSID20941522
  • Hyoscyamine [USP:BAN]
  • AKOS016843532
  • (S)-(leo)-hyoscyamine
  • DB00424
  • CHEMBL1331216
  • AC-34425
  • 101-31-5
  • Benzeneacetic acid, alpha-(hydroxymethyl)-, (3-endo)-8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, (alphaS)-
  • Hyoscyamine (USP)
  • Hyoscyaminum
  • BENZENEACETIC ACID, .ALPHA.-(HYDROXYMETHYL)-, (3-ENDO)-8-METHYL-8-AZABICYCLO(3.2.1)OCT-3-YL ESTER, (.ALPHA.S)-
  • HMS2231N11
  • [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (2S)-3-hydroxy-2-phenyl-propanoate
  • Tropine, (-)-tropate (ester)
  • (leo)-hyoscyamine
  • Tropine-L-tropate
  • AKOS015896332
  • D00147
  • 1alphaH,5alphaH-Tropan-3alpha-ol (-)-tropate (ester)
  • HYO
  • NSC 757064
  • tropan-3alpha-yl (2S)-3-hydroxy-2-phenylpropanoate
  • NCGC00179608-01
  • J-000364
  • Q27464129
  • HYOSCYAMINE [HSDB]
  • Benzeneacetic acid, .alpha.-(hydroxymethyl)-, (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, (.alpha.S)-
  • Symax SR
  • MLS001304011
  • BSPBio_000305
  • HYOSCYAMINE [VANDF]
  • Levbid
  • AS-75498
  • Hyospaz
  • Tropine, (-)-tropate
  • Tropic acid, (-)-, ester with tropine
  • Daturin
  • 4247B
  • ENDO-ATROPINE
  • OIN
  • SR-01000799139-2
  • (8-Methyl-8-azabicyclo[3.2.1]octan-3-yl)(2R)-3-hydroxy-2-phenylpropanoate
  • [(1S,5R)-8-methyl-8-Azabicyclo[3.2.1]Oct-3-yl] (2S)-3-Hydroxy-2-Phenyl-Propanoate
  • DATURINE
  • (S)-((1R,3r,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-hydroxy-2-phenylpropanoate
  • RKUNBYITZUJHSG-OFQRWUPVSA-N
  • CHEMBL1257084
  • L-Hyoscyamine (sulfate)
  • SCHEMBL41317
  • SCHEMBL19150033
  • AB01566903_01
  • CCG-208307
  • Azabicyclo(3.2.1)oct-3-yl ester, (3(S)-endo)-
  • (s)-hyoscyamine
  • NCGC00386240-01
  • Benzeneacetic acid, .alpha.-(hydroxymethyl)-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, [3(S)-endo]-
  • B785FB93-7373-4673-9EFB-E49344DB621C
  • J-521647
  • RKUNBYITZUJHSG-LGGPCSOHSA-N
  • SW219548-1
  • s4014
  • 1.alpha.H,5.alpha.H-Tropan-3.alpha.-ol, (-)-tropate (ester)
  • Daturine (sulfate)
  • HMS3885E18
  • Tropic acid, 1.alpha.H,5.alpha.H-tropan-3.alpha.-yl ester, (-)-
  • AKOS037514691
  • Hyoscyamine (Daturine)
  • (+-)-atropine
  • (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl tropate
  • dl-Hyoscyamine
  • l-hyoscyamine
  • 8-methyl-8-azabicyclo[3.2.1]oct-3-yl tropate
  • MLS002222283
  • dl-tropyltropate
  • (S)-(-)-hyoscyamine
  • MLS002153877
  • (+,-)-tropyl tropate
  • Atropine
  • (-)-hyoscyamine
  • 8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3-hydroxy-2-phenylpropanoate
  • Atropine sulfate monohydrate
  • (S)-atropine
  • atropina
  • Atropin
  • (+-)-hyoscyamine
  • tropine, (-)-tropate
  • tropan-3alpha-yl 3-hydroxy-2-phenylpropanoate
  • tropine tropate
  • (-)-atropine
  • SMR001233231
  • [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl] 3-hydroxy-2-phenyl-propanoate
  • L-Hyoscyamin
物化性质
实验特性
LogP 1.86880
PSA 49.77000
Merck 14,4858
折射率 1.5200 (estimate)
沸点 431.53°C (rough estimate)
熔点 108,5°C
闪点 213.7±28.7 °C
颜色与性状 Powder
溶解性 极易溶于乙醇和稀酸,易溶于氯仿,可溶于水、乙醚和苯。
酸度系数(pKa) pKa (21°) 9.7
比旋光度 D20 -21.0° (alc)
密度 1.0470 (rough estimate)
计算特性
精确分子量 289.16800
氢键供体数量 1
氢键受体数量 4
可旋转化学键数量 5
同位素质量 289.167794
重原子数量 21
复杂度 353
同位素原子数量 0
确定原子立构中心数量 3
不确定原子立构中心数量 0
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) 1.8
表面电荷 0
拓扑分子极性表面积 49.8
国际标准相关数据
EINECS 202-933-0
海关数据
海关编码 2933990090
海关数据

中国海关编码:

2933990090

概述:

2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

申报要素:

品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期

Summary:

2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

生产方法和用途
方法
颠茄浸膏经提取精制而得。
用途
生化研究,抗胆碱药及检测金的试剂。
生产方法 颠茄浸膏经提取精制而得。
专业数据库参考
PubChemId 154417
参考资料
Reaxys RN
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