A stereochemically accurate chemical substance database based on the systematic names of organic compounds. 1. Low molecular weight organic compounds.
A chemical substance database, containing chemical structures generated automatically from their IUPAC systematic names, is described. The structure generation program can convert the names of natural products, peptides, and stereochemically complex names into stereochemically correct connection tables. More than 300,000 commonly encountered compounds are stored in the database and are publicly accessible through the JOIS-F online system, which also offers mass spectral, thermochemical, and other factual databases.
Japan Information Center of Science & Technology (JICST), Tokyo, Japan.
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D000465:Algorithms; D002625:Chemistry, Organic; D016208:Databases, Factual; D007564:Japan; D015394:Molecular Structure; D008970:Molecular Weight; D055601:Organic Chemistry Phenomena; D012984:Software; D013237:Stereoisomerism; D009626:Terminology as Topic