65995-62-2 (2,2’-（2,3,7,8-四羟基-5,10-二氧代-5,10-二氢[1]苯并吡喃[5,4,3-cde][1]苯并吡喃-1,6-二基）双（3,4,5-三羟基苯甲酸）,2,2'-(2,3,7,8-Tetrahydroxy-5,10-dioxo-5,10-dihydro[1]benzopyrano[5,4,3-cde][1]benzopyran-1,6-diyl)bis(3,4,5-trihydroxybenzoic acid))

快速询单

结构式：

2,2’-（2,3,7,8-四羟基-5,10-二氧代-5,10-二氢[1]苯并吡喃[5,4,3-cde][1]苯并吡喃-1,6-二基）双（3,4,5-三羟基苯甲酸）MOL文件

CAS号：

65995-62-2

中文名称：

2,2’-（2,3,7,8-四羟基-5,10-二氧代-5,10-二氢[1]苯并吡喃[5,4,3-cde][1]苯并吡喃-1,6-二基）双（3,4,5-三羟基苯甲酸）

英文名称：

2,2'-(2,3,7,8-Tetrahydroxy-5,10-dioxo-5,10-dihydro[1]benzopyrano[5,4,3-cde][1]benzopyran-1,6-diyl)bis(3,4,5-trihydroxybenzoic acid)

分子式：

C₂₈H₁₄O₁₈

分子量：

638.399969577789

2,2’-（2,3,7,8-四羟基-5,10-二氧代-5,10-二氢[1]苯并吡喃[5,4,3-cde][1]苯并吡喃-1,6-二基）双（3,4,5-三羟基苯甲酸）(65995-62-2)名称与标识符

名称

英文别名：

AGN-PC-002FZG;Q5518842;2,2'-(2,3,7,8-Tetrahydroxy-5,10-dioxo-5,10-dihydro[1]benzopyrano[5,4,3-cde][1]benzopyran-1,6-diyl)bi;TSN85LPS4R;Benzoic acid, 2,2'-(5,10-dihydro-2,3,7,8-tetrahydroxy-5,10-dioxo(1)benzopyrano(5,4,3-cde)(1)benzopyran-1,6-diyl)bis(3,4,5-trihydroxy-, stereoisomer;DTXSID80563643;Gallagic acid;UNII-TSN85LPS4R;FT-0777848;2-(12-(6-Carboxy-2,3,4-trihydroxyphenyl)-6,7,13,14-tetrahydroxy-3,10-dioxo-2,9-dioxatetracyclo(6.6.2.04,16.011,15)hexadeca-1(14),4(16),5,7,11(15),12-hexaen-5-yl)-3,4,5-trihydroxybenzoic acid;Stereoisomer of 2,2'-(5,10-dihydro-2,3,7,8-tetrahydroxy-5,10-dioxo(1)benzopyrano(5,4,3-cde)(1)benzopyran-1,6-diyl)bis(3,4,5-trihydroxybenzoic acid);65995-62-2;

标识符

InChIKey：

ZASJRRFAYSNSHU-UHFFFAOYSA-N

Inchi：

1S/C28H14O18/c29-5-1-3(25(39)40)7(17(33)15(5)31)9-13-11-12-14(28(44)46-23(11)21(37)19(9)35)10(20(36)22(38)24(12)45-27(13)43)8-4(26(41)42)2-6(30)16(32)18(8)34/h1-2,29-38H,(H,39,40)(H,41,42)

SMILES：

O1C(C2C(C3C(=C(C(=CC=3C(=O)O)O)O)O)=C(C(=C3C=2C2=C1C(=C(C(C1C(=C(C(=CC=1C(=O)O)O)O)O)=C2C(=O)O3)O)O)O)O)=O

2,2’-（2,3,7,8-四羟基-5,10-二氧代-5,10-二氢[1]苯并吡喃[5,4,3-cde][1]苯并吡喃-1,6-二基）双（3,4,5-三羟基苯甲酸）(65995-62-2)物化性质

计算特性

精确分子量 : 638.01801359g/mol
氢键供体数量 : 12
氢键受体数量 : 18
可旋转化学键数量 : 4
同位素质量 : 638.01801359g/mol
重原子数量 : 46
复杂度 : 1170
同位素原子数量 : 0
确定原子立构中心数量 : 0
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） : 1.3
拓扑分子极性表面积 : 330

2,2’-（2,3,7,8-四羟基-5,10-二氧代-5,10-二氢[1]苯并吡喃[5,4,3-cde][1]苯并吡喃-1,6-二基）双（3,4,5-三羟基苯甲酸）(65995-62-2)相关文献

1. Dietary phenolics: chemistry, bioavailability and effects on health
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Lin-Sen Qing,Nan Tang,Ying Xue,Jian Liang,Yi-Ming Liu,Xun Liao Anal. Methods 2012 4 1612
3. Total phenolic content, antioxidant capacity and phytochemical profiling of grape and pomegranate wines
Dimitra Z. Lantzouraki,Vassilia J. Sinanoglou,Thalia Tsiaka,Charalampos Proestos,Panagiotis Zoumpoulakis RSC Adv. 2015 5 101683
4. The gut microbiota urolithin metabotypes revisited: the human metabolism of ellagic acid is mainly determined by aging
A. Cortés-Martín,R. García-Villalba,A. González-Sarrías,M. Romo-Vaquero,V. Loria-Kohen,A. Ramírez-de-Molina,F. A. Tomás-Barberán,M. V. Selma,J. C. Espín Food Funct. 2018 9 4100
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8. Finding solutions for agricultural wastes: antioxidant and antitumor properties of pomegranate Akko peel extracts and β-glucan recovery
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810668-53-2(Methyl (4Z,7S,8E,10Z,12E,14E,16R,17S,19Z)-7,16,17-trihydroxy-4,8, 10,12,14,19-docosahexaenoate) 81115-49-3(6-羧酸-5-氨基-1H-吲唑) 80880-90-6(替仑西平) 812640-83-8((1-(PYRIDIN-2-YL)CYCLOPROPYL)METHANAMINE) 81324-61-0(3-溴-4-甲氧基苯甲酰氯) 80650-47-1(2-chloro-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide) 809231-57-0(L-2-(BOC-AMINO)-3-(4'-METHOXYBIPHENYL-4-YL)PROPANOIC ACID) 811431-33-1(1-(6-氨基-9H-嘌呤-9-基)-1,5-二脱氧-2,3-O-(1-甲基亚乙基)-BETA-D-呋喃核己糖醛酸)

960化工网为您提供2,2’-（2,3,7,8-四羟基-5,10-二氧代-5,10-二氢[1]苯并吡喃[5,4,3-cde][1]苯并吡喃-1,6-二基）双（3,4,5-三羟基苯甲酸）专业化合物百科信息，包括中文名，英文名，分子式，分子量，以及该化合物的CasNo.65995-62-2,相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等。 WAP版:65995-62-2 国际站:65995-62-2

65995-62-2 (2,2’-（2,3,7,8-四羟基-5,10-二氧代-5,10-二氢[1]苯并吡喃[5,4,3-cde][1]苯并吡喃-1,6-二基）双（3,4,5-三羟基苯甲酸）,2,2'-(2,3,7,8-Tetrahydroxy-5,10-dioxo-5,10-dihydro[1]benzopyrano[5,4,3-cde][1]benzopyran-1,6-diyl)bis(3,4,5-trihydroxybenzoic acid))

2,2’-（2,3,7,8-四羟基-5,10-二氧代-5,10-二氢[1]苯并吡喃[5,4,3-cde][1]苯并吡喃-1,6-二基）双（3,4,5-三羟基苯甲酸）(65995-62-2)名称与标识符

名称

标识符

2,2’-（2,3,7,8-四羟基-5,10-二氧代-5,10-二氢[1]苯并吡喃[5,4,3-cde][1]苯并吡喃-1,6-二基）双（3,4,5-三羟基苯甲酸）(65995-62-2)物化性质

计算特性

2,2’-（2,3,7,8-四羟基-5,10-二氧代-5,10-二氢[1]苯并吡喃[5,4,3-cde][1]苯并吡喃-1,6-二基）双（3,4,5-三羟基苯甲酸）(65995-62-2)相关文献

目录