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Inchikey号

Webcas号涵盖从1957年至今的科学文献中确定的物质，其他物质可追溯到20世纪初。 它也称CAS编号(CAS Registry Number，或称CAS Number，CAS Rn，CAS #)，又称CAS登录号或CAS登记号码，是某种物质(化合物、高分子材料、生物序列(Biological sequences)、混合物或合金)的唯一的数字识别 ... WebSep 1, 2024 · One can use unichem from bioservices for this, however, these functions all require the InChIKey as input, e.g. KDXKERNSBIXSRK-YFKPBYRVSA-N Is it possible to interconvert the two using bioservices and if not is it possible to somehow use the functions in unichem with InChI rather than the InChIKey?

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WebDec 20, 2012 · InChIKey is a 27-character compacted (hashed) version of InChI which is intended for Internet and database searching/indexing and is based on an SHA-256 hash of the InChI character string. The first block of InChIKey encodes molecular skeleton while the second block represents various kinds of isomerism (stereo, tautomeric, etc.). WebDec 20, 2012 · InChIKey is a 27-character compacted (hashed) version of InChI which is intended for Internet and database searching/indexing and is based on an SHA-256 hash of the InChI character string. The first block of InChIKey encodes molecular skeleton while the second block represents various kinds of isomerism (stereo, tautomeric, etc.). InChIKey is … houzz window coverings https://unrefinedsolutions.com

InChIKey checker - www.InChI.info

WebMay 13, 2015 · 目前支持结构式、iupac名称、分子式、cas号、inchl key、数字标识cid、smiles等多种方式进行搜索。 为了方便大家使用，化合物百科模块已经加添加 … Web丙酸钾，化学式k(c 2 h 5 coo)。 它的熔点是410°c，是丙酸的钾 盐。. 用途. 它用作食品防腐剂，在欧洲中拥有食品标签e编码e283， 在澳大利亚和新西兰中拥有ins编号283。. 参考文献 WebOct 20, 2016 · Convert ID is a tool for converting entry identifiers (accession numbers) of outside databases to KEGG identifiers, which is necessary for most KEGG Mapper … houzz white kitchen with rustic dinner table

InChIKey - www.InChI.info

Category:InChI and InChIKey search UniChem - European Bioinformatics …

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Inchikey号

The Chemical Translation Service—a web-based tool to improve ...

Web本产品不向个人销售，仅用作科学研究，不用于任何人体实验及非科研性质的动物实验。 WebSep 1, 2024 · I would like to retrieve the InChI representation for a given KEGG compound but I fail to find a direct solution for this (preferably doing it via bioservices ). One could do it via ChEBI like this: from bioservices import * kegg_con = KEGG () kegg_entry = kegg_con.parse (kegg_con.get ('C00047')) chebi_con = ChEBI () chebi_entry = chebi_con ...

Inchikey号

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http://inchi.info/keygenerator_en.html WebN-Methyl-1H-pyrazole-1-ethanamine trihydrochloride, CAS号949100-10-1, 分子量为234.55, 分子式C6H14Cl3N3, 标准纯度95%, 毕得医药(Bidepharm)提供949100-10-1批次质检（如NMR, HPLC, GC）等检测报告。

WebDrugBank displays this information in the "Identification" section of the drug entry. InChI and the InChI key are displayed adjacently, allowing the user to take note of the difference between the two identifiers 3 . As seen in the attached image 3, the InChI key for theobromine is much shorter and easier to read than the InChi 3. WebJan 24, 2013 · Since its public introduction in 2005 the IUPAC InChI chemical structure identifier standard has become the international, worldwide standard for defined chemical structures. This article will describe the extensive use and dissemination of the InChI and InChIKey structure representations by and for the world-wide chemistry community, the …

The condensed, 27 character InChIKey is a hashed version of the full InChI (using the SHA-256 algorithm), designed to allow for easy web searches of chemical compounds. The standard InChIKey is the hashed counterpart of standard InChI. Most chemical structures on the Web up to 2007 have been represented as GIF files, which are not searchable for chemical content. The full InChI turne… WebInChIKey is a fixed-length format directly derived from InChI. It is based on a strong hash (SHA-256 algorithm) of an InChI string. Because of the hash nature of the InChIKey, there …

WebThis service works as a resolver for different chemical structure identifiers and allows one to convert a given structure identifier into another representation or structure identifier. It can help you identify and find the chemical structure if …

WebDetroit, Michigan's Local 4 News, headlines, weather, and sports on ClickOnDetroit.com. The latest local Detroit news online from NBC TV's local affiliate in Detroit, Michigan, WDIV - … houzz white sofaWebChemicalBook 提供有关八氯化萘(2234-13-1)傅里叶红外光谱图的核磁图,红外图谱,Raman光谱,质谱等图谱 how many goldfish per servingWebOur Detroit family can be reached through the following contact information: 313-723-1493. [email protected]. how many goldfish per gallon of waterWebDetroit is a city located in Wayne County Michigan.It is also the county seat of Wayne County.With a 2024 population of 621,193, it is the largest city in Michigan and the 27th … houzz wine cellarsWebInChIKey: InChIKey string list. SMILES: SMILES string list. Synonyms: Synonym string list. The input list can be provided by text, a file, or Entrez history. Registry IDs, SIDs, CIDs, … how many gold gloves did al kaline winWebInChIKey checker The last character of an InChIKey is computed from the rest of the InChIKey and can be used to determine if the key wasn’t unintentionally changed during … houzz window shadesWebJul 3, 2024 · InChI=1S/C6H8O6/c7-1-2 (8)5-3 (9)4 (10)6 (11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1. InChI Key：CIWBSHSKHKDKBQ-JLAZNSOCSA-N. InChIKey 是对 InChI 运用 … houzz white kitchens