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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > monocarboxylic acid amide > fatty amide > gymnastatin-a2
organooxygen compound > carboxamide > monocarboxylic acid amide > fatty amide > gymnastatin-a2
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > monocarboxylic acid amide > fatty amide > gymnastatin-a2
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > fatty amide > gymnastatin-a2

Preferred term

gymnastatin-a2  

Type

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

Broader concept

charge

  • 0

formula

  • C23H31Cl2NO4

inchi

  • InChI=1S/C23H31Cl2NO4/c1-4-5-6-7-8-15(2)11-16(3)9-10-20(27)26-19-14-23(30-22(19)29)12-17(24)21(28)18(25)13-23/h9-13,15,19,22,29H,4-8,14H2,1-3H3,(H,26,27)/b10-9+,16-11+/t15-,19+,22+/m1/s1

inchikey

  • NGXMXBNROHVABT-ZHTHRGMRSA-N

mass

  • 456.400

monoisotopicmass

  • 455.16301

smiles

  • ClC=1C(=O)C(Cl)=CC2(C1)O[C@H](O)[C@H](C2)NC(=O)/C=C/C(=C/[C@@H](CCCCCC)C)/C

subset

  • 2_STAR

synonym EXACT

  • (2E,4E,6R)-N-[(2S,3S)-7,9-dichloro-2-hydroxy-8-oxo-1-oxaspiro[4.5]deca-6,9-dien-3-yl]-4,6-dimethyldodeca-2,4-dienamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209363

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