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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > fatty acid > medium-chain fatty acid > botrytisic acid a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > fatty acid > medium-chain fatty acid > botrytisic acid a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > fatty acid > medium-chain fatty acid > botrytisic acid a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic acid > carboxylic acid > monocarboxylic acid > fatty acid > medium-chain fatty acid > botrytisic acid a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid > medium-chain fatty acid > botrytisic acid a

Preferred term

botrytisic acid a  

Type

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

Broader concept

charge

  • 0

formula

  • C15H20O3

inchi

  • InChI=1S/C15H20O3/c1-11(10-12(16)17)6-9-15(4)8-5-7-14(2,3)13(15)18/h5-6,8-10H,7H2,1-4H3,(H,16,17)/b9-6+,11-10-/t15-/m1/s1

inchikey

  • YMEFRSQFXGVNCO-YKYZAGTJSA-N

mass

  • 248.322

monoisotopicmass

  • 248.14124

smiles

  • O=C1[C@](C=CCC1(C)C)(/C=C/C(=C/C(=O)O)/C)C

subset

  • 2_STAR

synonym EXACT

  • (2Z,4E)-3-methyl-5-(1,5,5-trimethyl-6-oxocyclohex-2-en-1-yl)penta-2,4-dienoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223173

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