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Concept information

Preferred term

aflaquinolone h  

Type

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

Broader concept

charge

  • 0

formula

  • C26H29NO6

inchi

  • InChI=1S/C26H29NO6/c1-24(14-12-19(28)25(2,31)15-24)13-11-16-9-10-18-20(21(16)29)26(32,17-7-5-4-6-8-17)22(33-3)23(30)27-18/h4-11,13,22,29,31-32H,12,14-15H2,1-3H3,(H,27,30)/b13-11+/t22-,24-,25+,26+/m1/s1

inchikey

  • OYOKDZBQGKJNKC-YKHZTBTGSA-N

mass

  • 451.519

monoisotopicmass

  • 451.19949

smiles

  • O=C1NC2=C(C(O)=C(/C=C/[C@]3(C[C@](O)(C(=O)CC3)C)C)C=C2)[C@@]([C@@H]1OC)(O)C4=CC=CC=C4

subset

  • 2_STAR

synonym EXACT

  • (3S,4S)-4,5-dihydroxy-6-[(E)-2-[(1R,3S)-3-hydroxy-1,3-dimethyl-4-oxocyclohexyl]ethenyl]-3-methoxy-4-phenyl-1,3-dihydroquinolin-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215041

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