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Merck
CN

09626

原卟啉 IX 二甲酯

~90% (HPLC)

别名:

二甲基-8,13-二乙烯基3,7,12,17四甲基-21H,23H-卟吩-2,18二丙, 间卟啉二甲酯

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关于此项目

经验公式（希尔记法）:
C36H38N4O4
化学文摘社编号:
5522-66-7
分子量:
590.71
NACRES:
NA.32
PubChem Substance ID:
329748780
UNSPSC Code:
12171500
EC Number:
226-870-3
MDL number:
MFCD00064531
Beilstein/REAXYS Number:
381574

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产品名称

原卟啉 IX 二甲酯, ~90% (HPLC)

solubility

chloroform: soluble
diethyl ether: soluble
DMSO: soluble
THF: soluble
acetone: soluble
ethyl acetate: soluble
methanol: soluble

SMILES string

COC(=O)CCc1c(C)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(CCC(=O)OC)c5C)c(C)c4C=C)c(C)c3C=C
COC(=O)CCc1c(C)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(CCC(=O)OC)c5C)c(C)c4C=C)c(C)c3C=C

InChI key

XNCGCBXDDMJCKW-MFBGAUBSSA-N

InChI

1S/C36H38N4O4/c1-9-23-19(3)27-15-28-21(5)25(11-13-35(41)43-7)33(39-28)18-34-26(12-14-36(42)44-8)22(6)30(40-34)17-32-24(10-2)20(4)29(38-32)16-31(23)37-27/h9-10,15-18,38-39H,1-2,11-14H2,3-8H3/b27-15-,28-15-,29-16-,30-17-,31-16-,32-17-,33-18-,34-18-

assay

~90% (HPLC)

form

powder

mp

225-228 °C (lit.)

Quality Level

100

Gene Information

human ... TERT(7015)

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Application

原卟啉IX二甲基酯已被证明是人鼻咽癌的一种有效光敏剂。

Packaging

无底玻璃瓶。内含物在插入的融合锥体内。

存储类别

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

历史批次信息供参考:

分析证书(COA)

Lot/Batch Number
BCCL4841
BCCF8438
BCCC1184
BCBT7964
BCBS7525V

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L L Gladkov et al.
Biofizika, 42(1), 26-33 (1997-01-01)
Normal coordinate analysis has been carried out for the Fe(III) protoporphyrin IX dimethyl ester molecule and its vinyl deuterated analogs. All atoms of substituents were included explicitly in the calculations. On the basis of the calculation results the assignment of
E A Shliapnikova et al.
Molekuliarnaia biologiia, 20(1), 138-145 (1986-01-01)
The fluorescent properties of the complexes of apoMb-PPIX and dimethyl-PPIX were studied in a wide range of pH and ionic strength. The quenching of fluorescence of PPIX in the complex by I- is shown to be of dynamic type Increasing
S Ookubo et al.
Journal of inorganic biochemistry, 29(1), 1-23 (1987-01-01)
Complex formation of 5-coordinated iron(III) heme containing thiolate anion (p-nitrothiophenol) with imidazole (1-methylimidazole) showed very interesting features depending on the nature of the solvent and the ratio of the ligand to heme. The complexes formed under different conditions were not
P Kubát et al.
Radiation research, 148(4), 382-385 (1997-10-27)
The formation of triplet states of photosensitizers and singlet oxygen during reactions sensitized by protoporphyrin IX dimethyl ester (PPDME) and the products of its photo-oxidation in solution were studied by time-resolved spectroscopy. Irradiation with long-wavelength light (670 nm), which is
S Ookubo et al.
Journal of inorganic biochemistry, 35(4), 305-317 (1989-04-01)
Magnetic circular dichroism (MCD) spectra were observed to characterize the nature of the visible bands for high-spin Fe(III) protoheme derivatives with p-nitrothiophenolate, p-nitrophenolate, and methoxy anion as the fifth ligands in several solvents. The visible MCD bands for p-nitrophenolate heme
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