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Chemistry, part 2

Content language

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Concept information

organooxygen compound > carbonyl compound > carboxylic acid > dicarboxylic acid > ethyl homononactyl homononactate
... > 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 > dicarboxylic acid > ethyl homononactyl homononactate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > dicarboxylic acid > ethyl homononactyl homononactate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic acid > carboxylic acid > dicarboxylic acid > ethyl homononactyl homononactate

Preferred term

ethyl homononactyl homononactate  

Type

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

Broader concept

charge

  • 0

formula

  • C24H42O7

inchi

  • InChI=1S/C24H42O7/c1-6-17(25)13-19-9-11-22(29-19)16(5)24(27)31-18(7-2)14-20-10-12-21(30-20)15(4)23(26)28-8-3/h15-22,25H,6-14H2,1-5H3/t15-,16+,17-,18+,19-,20+,21-,22+/m1/s1

inchikey

  • ARDYSKFJCQGKCQ-ZFCULDQTSA-N

mass

  • 442.593

monoisotopicmass

  • 442.29305

smiles

  • O=C(O[C@H](C[C@H]1O[C@@H]([C@H](C(=O)OCC)C)CC1)CC)[C@H]([C@H]2O[C@@H](C[C@H](O)CC)CC2)C

subset

  • 2_STAR

synonym EXACT

  • [(2S)-1-[(2S,5R)-5-[(2R)-1-ethoxy-1-oxopropan-2-yl]oxolan-2-yl]butan-2-yl] (2S)-2-[(2S,5R)-5-[(2R)-2-hydroxybutyl]oxolan-2-yl]propanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207960

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