(acetyloxy)methyl 2-({2-[(acetyloxy)methoxy]-2-oxoethyl}[2-(2-{2-[bis({2-[(acetyloxy)methoxy]-2-oxoethyl})amino]phenoxy}ethoxy)phenyl]amino)acetate

• ChemBase编号: 81071
• 分子式: C34H40N2O18
• 平均质量: 764.684
• 单一同位素质量: 764.22761245
• SMILES: N(c1c(cccc1)OCCOc1c(cccc1)N(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C
• Canonical SMILES: O=C(CN(c1ccccc1OCCOc1ccccc1N(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)OCOC(=O)C
• InChI: InChI=1S/C34H40N2O18/c1-23(37)47-19-51-31(41)15-35(16-32(42)52-20-48-24(2)38)27-9-5-7-11-29(27)45-13-14-46-30-12-8-6-10-28(30)36(17-33(43)53-21-49-25(3)39)18-34(44)54-22-50-26(4)40/h5-12H,13-22H2,1-4H3
• InChIKey: YJIYWYAMZFVECX-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: (acetyloxy)methyl 2-({2-[(acetyloxy)methoxy]-2-oxoethyl}[2-(2-{2-[bis({2-[(acetyloxy)methoxy]-2-oxoethyl})amino]phenoxy}ethoxy)phenyl]amino)acetate
• IUPAC传统名: (acetyloxy)methyl 2-({2-[(acetyloxy)methoxy]-2-oxoethyl}[2-(2-{2-[bis({2-[(acetyloxy)methoxy]-2-oxoethyl})amino]phenoxy}ethoxy)phenyl]amino)acetate
• 别名: 1,2-Bis(2-aminophenoxy)ethane-N,N,N′,N′-tetraacetic acid tetrakis(acetoxymethyl ester); BAPTA-AM; N,N'-[1,2-Ethanediylbis(oxy-2,1-phenylene)]bis[N-[2-[(acetyloxy)methoxy]-2-oxoethyl]glycine 1,1'-Bis[(acetyloxy)methyl] Ester; 1,2-Bis(2-aminophenoxy)ethane-N,N,N’,N’-tetraacetic Acid Tetraacetoxymethyl Ester; BAPTA-AM; BAPTA-AM; 1,2-Bis(2-aminophenoxy)ethane-N,N,N',N'-tetraacetic acid, tetraacetoxymethyl ester; 1,2-bis(o-AMINOPHENOXY)ETHANE-N,N,N',N'-TETRAACETIC ACID TETRAACETOXYMETHYL ESTER

登记号

• CAS号: 126150-97-8
• MDL号: MFCD00036696
• Beilstein号: 7458534
• PubChem SID: 24890502; 162068190; 24847309
• PubChem CID: 2293

理论计算性质

• 质子受体: 12
• 质子供体: 0
• LogD (pH = 5.5): 1.6157187
• LogD (pH = 7.4): 1.6157187
• Log P: 1.6157187
• 摩尔折射率: 176.3586 cm^3
• 极化性: 70.69166 Å^3
• 极化表面积: 235.34 Å^2
• 可自由旋转的化学键: 31
• 里宾斯基五规则: false

分子性质

理化性质

• 溶解度: Chloroform; DMSO
• 外观: White to Off-White Solid
• 熔点: 94-96°C

安全信息

• 保存条件: -20°C; Hygroscopic, -20°C Freezer, Under Inert Atmosphere
• 保存注意事项: Irritant/Store at -20°C
• 欧盟危险性物质标志: 刺激性(Irritant) (Xi)
• 德国WGK号: 3
• 危险公开号: 36/37/38
• 安全公开号: 26-36
• GHS危险品标识: GHS07
• GHS警示词: Warning
• GHS危险声明: H315-H319-H335
• GHS警示性声明: P261-P305 + P351 + P338
• 个人保护装置: dust mask type N95 (US), Eyeshields, Gloves
• 保存温度: -20°C

药理学性质

• 作用靶点: Others

产品相关信息

• 纯度: >90%; ≥95% (HPLC); ≥98.0% (HPLC)
• 成盐信息: Free Base
• Empirical Formula (Hill Notation): C34H40N2O18

详细说明

MP Biomedicals - 02195709

Purity: >90%
A cell permeable derivative of BAPTA widely used as an intracellular calcium sponge.

Apollo Scientific Ltd - OR2370T

A cell permeable derivative of BAPTA.

Sigma Aldrich - A1076

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Biochem/physiol Actions
Selective chelator of intracellular Ca2+ stores.
Linkage
Membrane-permeable form of BAPTA.

Sigma Aldrich - 11696

Other Notes
Membrane-permeable form of BAPTA. Can be loaded into cells where it is hydrolysed by cytosolic esterases and trapped as the active chelator1

Toronto Research Chemicals - B123700

BAPTA-AM is a lipophilic diester of BAPTA used for inhibition of proteolytic activities of certain metalloproteinases, calpain and TACE. Fluorescence: max. Abs. 287nm; e x 10-3: 5.9

参考文献

• Li, B., et al.: Brain Res., 1226, 199 (2008)
• Chen, W., et al.: Mol. Endocrinol., 22, 1754 (2008)
• Tonkikh, A., et al.: Neurosci., 159, 1300 (2008)