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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > methyl (s)-8-hydroxy-6-methoxy-5-methyl-4a-(3-oxobutan-2-yl)benzoate
... > organooxygen compound > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > methyl (s)-8-hydroxy-6-methoxy-5-methyl-4a-(3-oxobutan-2-yl)benzoate
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > methyl (s)-8-hydroxy-6-methoxy-5-methyl-4a-(3-oxobutan-2-yl)benzoate
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > methyl (s)-8-hydroxy-6-methoxy-5-methyl-4a-(3-oxobutan-2-yl)benzoate
organic aromatic compound > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > methyl (s)-8-hydroxy-6-methoxy-5-methyl-4a-(3-oxobutan-2-yl)benzoate

Preferred term

methyl (s)-8-hydroxy-6-methoxy-5-methyl-4a-(3-oxobutan-2-yl)benzoate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C14H18O5

inchi

  • InChI=1S/C14H18O5/c1-7(9(3)15)12-8(2)11(18-4)6-10(16)13(12)14(17)19-5/h6-7,16H,1-5H3/t7-/m1/s1

inchikey

  • SMOXLKTYOHPSFE-SSDOTTSWSA-N

mass

  • 266.293

monoisotopicmass

  • 266.11542

smiles

  • O=C(OC)C1=C(O)C=C(OC)C(=C1[C@@H](C(=O)C)C)C

subset

  • 2_STAR

synonym EXACT

  • methyl 6-hydroxy-4-methoxy-3-methyl-2-[(2S)-3-oxobutan-2-yl]benzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:222298

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