87075-24-9 ([5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide,[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide)

结构式：

[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamideMOL文件

CAS号：

87075-24-9

中文名称：

[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide

英文名称：

[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide

分子式：

C₁₅H₁₆Br₂N₄O₄

分子量：

476.119941711426

[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide(87075-24-9)名称与标识符

名称

英文别名：

[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide;(5S,6R)-7,9-dibromo-6-hydroxy-N-[2-(1H-imidazol-5-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,7,9-triene-3-carboxamide;Aerophobin-1;DTXSID60434761;87075-24-9;CHEMBL564524;CHEBI:80952;C17162;8T9Z8LWD8J;UNII-8T9Z8LWD8J;aerophobin 1;Q27154923;(5R,6S)-7,9-Bis(bromanyl)-N-(2-(1H-imidazol-5-yl)ethyl)-8-methoxy-6-oxidanyl-1-oxa-2-azaspiro(4.5)deca-2,7,9-triene-3-carboxamide;1-Oxa-2-azaspiro(4.5)deca-2,6,8-triene-3-carboxamide, 7,9-dibromo-10-hydroxy-N-(2-(1H-imidazol-4-yl)ethyl)-8-methoxy-, (5S,6R)-;

标识符

InChIKey：

MDUQIEXQKMPARD-DZGCQCFKSA-N

Inchi：

1S/C15H16Br2N4O4/c1-24-12-9(16)4-15(13(22)11(12)17)5-10(21-25-15)14(23)19-3-2-8-6-18-7-20-8/h4,6-7,13,22H,2-3,5H2,1H3,(H,18,20)(H,19,23)/t13-,15+/m0/s1

SMILES：

O1[C@]2(C=C(Br)C(OC)=C(Br)[C@@H]2O)CC(C(NCCC2NC=NC=2)=O)=N1

[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide(87075-24-9)物化性质

计算特性

精确分子量 : 475.95178g/mol
氢键供体数量 : 3
氢键受体数量 : 6
可旋转化学键数量 : 5
同位素质量 : 473.95383g/mol
重原子数量 : 25
复杂度 : 651
同位素原子数量 : 0
确定原子立构中心数量 : 2
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） : 0.4
拓扑分子极性表面积 : 109Å²

[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide(87075-24-9)相关文献

1. Marine chemical ecology in benthic environments
Valerie J. Paul,Raphael Ritson-Williams,Koty Sharp Nat. Prod. Rep. 2011 28 345
2. Marine chemical ecology in benthic environments
Valerie J. Paul,Raphael Ritson-Williams,Koty Sharp Nat. Prod. Rep. 2011 28 345
3. Deep-sea natural products
Danielle Skropeta Nat. Prod. Rep. 2008 25 1131
4. Marine chemical ecology in benthic environments
Melany P. Puglisi,Jennifer M. Sneed,Koty H. Sharp,Raphael Ritson-Williams,Valerie J. Paul Nat. Prod. Rep. 2014 31 1510
5. Marine natural products
D. J. Faulkner Nat. Prod. Rep. 1987 4 539
6. Egg toxic compounds in the animal kingdom. A comprehensive review
Matías L. Giglio,Wilhelm Boland,Horacio Heras Nat. Prod. Rep. 2022 39 1938
7. Index pages
Nat. Prod. Rep. 1984 1 I1
8. Index pages
Nat. Prod. Rep. 1987 4 I1
9. Intramolecular oxidative cyclisation of 1-(4-hydroxyaryl)-2-ketoximes 4-HOArCh2C(NOH)R with phenytiodine(III) bis(trifluoroacetate)
Mesut Ka?an,Demet Koyuncu,Alexander McKillop J. Chem. Soc. Perkin Trans. 1 1993 1771
10. Marine natural products
D. J. Faulkner Nat. Prod. Rep. 1991 8 97

83133-14-6(袁华宁) 83164-93-6(3-(乙基磺酰基)苯胺) 83180-55-6(N-METHYL-N-4-PIPERIDINYLACETAMIDE) 83198-63-4(Verrucosin) 83194-70-1(4-羟基-2,6-二甲基-苯甲酸甲酯) 82745-72-0(2-(4-methylphenyl)sulfonyloxybenzoic acid) 832113-98-1(1-fluoro-2-isothiocyanato-4-methylbenzene) 832117-79-0((2R,3R,5S,6S)-5,6-双(叠氮甲基)-2,3-二甲氧基-2,3-二甲基-1,4-二氧己环)

960化工网为您提供[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide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.87075-24-9,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:87075-24-9 国际站:87075-24-9

87075-24-9 ([5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide,[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide)

[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide(87075-24-9)名称与标识符

名称

标识符

[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide(87075-24-9)物化性质

计算特性

[5S,10β,(+)]-7,9-Dibromo-10-hydroxy-N-[2-(1H-imidazole-4-yl)ethyl]-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide(87075-24-9)相关文献

目录