3566-99-2 (5-hydroxy-8,10-dimethoxy-2-methylbenzo[h]chromen-4-one,5-hydroxy-8,10-dimethoxy-2-methylbenzo[h]chromen-4-one)

快速询单

结构式：

5-hydroxy-8,10-dimethoxy-2-methylbenzo[h]chromen-4-oneMOL文件

CAS号：

3566-99-2

中文名称：

5-hydroxy-8,10-dimethoxy-2-methylbenzo[h]chromen-4-one

英文名称：

5-hydroxy-8,10-dimethoxy-2-methylbenzo[h]chromen-4-one

分子式：

C₁₆H₁₄O₅

分子量：

286.279365062714

5-hydroxy-8,10-dimethoxy-2-methylbenzo[h]chromen-4-one(3566-99-2)名称与标识符

名称

中文别名：

5-hydroxy-8,10-dimethoxy-2-methylbenzo[h]chromen-4-one;

英文别名：

5-hydroxy-8,10-dimethoxy-2-methylbenzo[h]chromen-4-one;CTK8I3907;Asperxanthon;flavasperone;AC1NX8TB;Flavasperon;5-hydroxy-8,10-dimethoxy-2-methyl-benzo[h]chromen-4-one;1-Methyl-4-oxo-5-hydroxy-8,10-dimethoxy-4H-naphtho<1.2-b>pyran;5-Hydroxy-8,10-dimethoxy-2-methyl-benzo[h]chromen-4-on;4H-Naphtho(1,2-b)pyran-4-one, 5-hydroxy-8,10-dimethoxy-2-methyl-;Flavosperon;CTK8I3907; Asperxanthon; flavasperone; AC1NX8TB; Flavasperon; 5-hydroxy-8,10-dimethoxy-2-methyl-benzo[h]chromen-4-one; 1-Methyl-4-oxo-5-hydroxy-8,10-dimethoxy-4H-naphtho< 1.2-b> pyran; 5-Hydroxy-8,10-dimethoxy-2-methyl-benzo[h]chromen-4-on; 4H-Naphtho(1,2-b)pyran-4-one, 5-hydroxy-8,10-dimethoxy-2-methyl-; Flavasperone; Flavosperon;;UNII-QUS3F7KQ3E;SCHEMBL16226658;5-hydroxy-8,10-dimethoxy-2-methyl-4H-naphtho[1,2-b]pyran-4-one;CHEMBL4645135;TMC 256c2;QUS3F7KQ3E;3566-99-2;DTXSID40189166;5-Hydroxy-8,10-dimethoxy-2-methyl-4H-naphtho[1,2-b]pyran-4-one, 9CI;Antibiotic TMC 256c2;TMD256C2;5-HYDROXY-8,10-DIMETHOXY-2-METHYL-4H-NAPHTHO(1,2-B)PYRAN-4-ONE;ASPERXANTHONE;5-hydroxy-8,10-dimethoxy-2-methyl-4H-benzo[h]chromen-4-one;CHEBI:133814;

标识符

InChIKey：

ARXPDHLVDOYIPX-UHFFFAOYSA-N

Inchi：

1S/C16H14O5/c1-8-4-11(17)15-12(18)6-9-5-10(19-2)7-13(20-3)14(9)16(15)21-8/h4-7,18H,1-3H3

SMILES：

O1C(C)=CC(C2=C(C=C3C=C(C=C(C3=C12)OC)OC)O)=O

5-hydroxy-8,10-dimethoxy-2-methylbenzo[h]chromen-4-one(3566-99-2)物化性质

实验特性

PSA : 64.99

计算特性

精确分子量 : 286.08412
氢键供体数量 : 1
氢键受体数量 : 5
可旋转化学键数量 : 2
同位素质量 : 286.08412354g/mol
重原子数量 : 21
复杂度 : 446
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） : 3.3
拓扑分子极性表面积 : 65Å²

5-hydroxy-8,10-dimethoxy-2-methylbenzo[h]chromen-4-one(3566-99-2)相关文献

1. 929. Studies in mycological chemistry. Part XIV. Synthesis of flavasperone
B. W. Bycroft,John C. Roberts J. Chem. Soc. 1963 4868
2. 8. Studies in mycological chemistry. Part VIII. The structure of flavasperone (“asperxanthone”), a metabolite of Aspergillus niger
B. W. Bycroft,T. A. Dobson,John C. Roberts J. Chem. Soc. 1962 40
3. Structural elucidation of the nigerones, four new naphthopyrones from cultures of Aspergillus niger
Dharles P. Gorst-Allman,Pieter S. Stern,Christiaan J. Rabie J. Chem. Soc. Perkin Trans. 1 1980 2474
4. Current status of secondary metabolite pathways linked to their related biosynthetic gene clusters in Aspergillus section Nigri
Xinhui Wang,Scott A. Jarmusch,Jens C. Frisvad,Thomas O. Larsen Nat. Prod. Rep. 2023 40 237
5. Regio- and stereoselective intermolecular phenol coupling enzymes in secondary metabolite biosynthesis
Wolfgang Hüttel,Michael Müller Nat. Prod. Rep. 2021 38 1011
6. Bioactive natural products derived from mangrove-associated microbes
Jing Xu RSC Adv. 2015 5 841
7. Total synthesis of chiral biaryl natural products by asymmetric biaryl coupling
Marisa C. Kozlowski,Barbara J. Morgan,Elizabeth C. Linton Chem. Soc. Rev. 2009 38 3193
8. Natural product diversity from the endophytic fungi of the genus Aspergillus
Seham S. El-hawary,Abeer S. Moawad,Hebatallah S. Bahr,Usama Ramadan Abdelmohsen,Rabab Mohammed RSC Adv. 2020 10 22058
9. Journal: index of subjects, 1962
J. Chem. Soc. 1962 5337
10. Synthesis of asperenone [all-trans(E)-8-methyl-13-phenyltrideca-4,6,8,10,12-pentaen-3-one], a pigment of Aspergillus species of fungi
Gerald Pattenden J. Chem. Soc. C 1970 1404

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