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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > fatty acid ester > ng-391
organooxygen compound > carbonyl compound > carboxylic ester > fatty acid ester > ng-391
... > 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 ester > fatty acid ester > ng-391
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > fatty acid ester > ng-391
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > fatty acid ester > ng-391

Preferred term

ng-391  

Type

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

Broader concept

charge

  • 0

formula

  • C22H27NO7

inchi

  • InChI=1S/C22H27NO7/c1-5-16(18(26)29-4)13-14(2)9-7-6-8-10-15(3)17(25)22-19(30-22)21(28,11-12-24)23-20(22)27/h5-10,13,19,24,28H,11-12H2,1-4H3,(H,23,27)/b8-6+,9-7+,14-13+,15-10+,16-5+/t19-,21-,22-/m0/s1

inchikey

  • OHWILISHWFHITP-OCKBFZBYSA-N

mass

  • 417.458

monoisotopicmass

  • 417.17875

smiles

  • O=C1N[C@](O)(CCO)[C@H]2[C@@]1(O2)C(=O)/C(=C/C=C/C=C/C(=C/C(/C(=O)OC)=C/C)/C)/C

subset

  • 2_STAR

synonym EXACT

  • methyl (2E,3E,5E,7E,9E)-2-ethylidene-11-[(1R,4S,5R)-4-hydroxy-4-(2-hydroxyethyl)-2-oxo-6-oxa-3-azabicyclo[3.1.0]hexan-1-yl]-4,10-dimethyl-11-oxoundeca-3,5,7,9-tetraenoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:202020

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