似梨木双黄酮-7-O-β-D-吡喃葡萄糖苷 | 50276-96-5
中文名称:
似梨木双黄酮-7-O-β-D-吡喃葡萄糖苷
英文名称:
Ochnaflavone
CAS No.:
50276-96-5
分子式:
C3 0 H1 8 O1 0
分子量:
538.45792
名称和标识符
MDL
MFCD24369679
InChIKey
NNPGECDACGBKDH-UHFFFAOYSA-N
Inchi
InChI=1S/C30H18O10/c31-16-8-20(34)29-22(36)12-24(39-27(29)10-16)14-1-4-18(5-2-14)38-26-7-15(3-6-19(26)33)25-13-23(37)30-21(35)9-17(32)11-28(30)40-25/h1-13,31-35H
SMILES
O=C1C=C(C2=CC=C(OC3=CC(C4=CC(C5=C(O4)C=C(O)C=C5O)=O)=CC=C3O)C=C2)OC6=C1C(O)=CC(O)=C6
别名信息
- 中文别名 -
似梨木双黄酮-7-O-β-D-吡喃葡萄糖苷
似梨木双黄酮
似梨木双黄酮-7-O-B-D-吡喃葡萄糖苷
似梨木双黄酮-7-O-B-D-吡喃葡萄糖苷对照品
似梨木双黄酮-7-O-beta-D-吡喃葡萄糖苷
似梨木双黄酮-7-O-β-D-吡喃葡萄糖苷对照品
金银花双黄酮
- 英文别名 -
Ochnaflavone7-O-β-D-gluco-pyranoside
4H-1-Benzopyran-4-one,2-[4-[5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenoxy]phenyl]-5,7-dihydroxy-
Ochnaflavone
2,3-dihydroochnaflavone
Ochinaflavone
2-[4-[5-(5,7-Dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenoxy]phenyl]-5,7-dihydroxy-4H-1-benzopyran-4-one
4H-1-Benzopyran-4-one, 2-[4-[5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenoxy]phenyl]-5,7-dihydroxy-
4H-1-Benzopyran-4-one, 2-(4-(5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenoxy)phenyl)-5,7-dihydroxy-
AKOS016010710
50276-96-5
SCHEMBL13829452
5B97Q9UZ5T
2-[4-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenoxy]phenyl]-5,7-dihydroxychromen-4-one
Q17099497
Ochnaflavone7-O-beta-D-gluco-pyranoside
CHEBI:194126
DTXSID70198281
2-(4-(5-(5,7-BIS(OXIDANYL)-4-OXIDANYLIDENE-CHROMEN-2-YL)-2-OXIDANYL-PHENOXY)PHENYL)-5,7-BIS(OXIDANYL)CHROMEN-4-ONE
UNII-5B97Q9UZ5T
物化性质
实验特性
LogP
5.55370
PSA
170.80000
折射率
1.77
沸点
832.1°C at 760 mmHg
蒸气压
0.0±3.2 mmHg at 25°C
闪点
281.5°C
颜色与性状
Yellow powder
密度
1.622
计算特性
精确分子量
538.09000
氢键供体数量
5
氢键受体数量
10
可旋转化学键数量
4
同位素质量
538.089997
重原子数量
40
复杂度
1030
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)
5.3
互变异构体数量
828
表面电荷
0
拓扑分子极性表面积
163
相关文献
1.
Ochnaflavone and its derivatives: a new series of diflavonyl ethers from Ochna squarrosa Linn
Masayoshi Okigawa,Nobusuke Kawano,Mohammad Aqil,Wasiur Rahman J. Chem. Soc. Perkin Trans. 1 1976 580
2.
Index of subjects, 1976
J. Chem. Soc. Perkin Trans. 1 1976 2621
3.
Recent advances in anti-HIV natural products
Inder Pal Singh,Hardik S. Bodiwala Nat. Prod. Rep. 2010 27 1781
4.
Flavonoids and their glycosides, including anthocyanins
Nigel C. Veitch,Renée J. Grayer Nat. Prod. Rep. 2011 28 1626
5.
Contents pages
J. Chem. Soc. Perkin Trans. 1 1976 P011
6.
A holistic comparison of flavor signature and chemical profile in different harvesting periods of Chrysanthemum morifolium Ramat. based on metabolomics combined with bioinformatics and molecular docking strategy
Mengxin Yang,Xi Tian,Miaoting Zhang,Jinhuan Wei,Yukun Niu,Jiali Hou,Yiran Jin,Yingfeng Du RSC Adv. 2022 12 34971
7.
Application of a lanthanide shift reagent, Eu(fod)3 to the elucidation of the structures of flavones and related compounds
Masayoshi Okigawa,Nizam U. Khan,Nobusuke Kawano,Wasiur Rahman J. Chem. Soc. Perkin Trans. 1 1975 1563
8.
Index of authors, 1976
J. Chem. Soc. Perkin Trans. 1 1976 2597
化合物详情(旧版)
物理化学性质
产品用途
应用领域
化学品安全说明书(MSDS)
储运特性