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Concept information

Preferred term

Montagnuphilone A  

Type

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

Broader concept

charge

  • 0

formula

  • C21H20O9

inchi

  • InChI=1S/C21H20O9/c1-10-5-12(22)8-15(23)18(10)20(27)30-16-7-11-6-13(3-4-17(24)25)29-9-14(11)19(26)21(16,2)28/h3-6,8,16,22-23,28H,7,9H2,1-2H3,(H,24,25)/b4-3+/t16-,21-/m0/s1

inchikey

  • JIHUSDLTKANHNQ-HXOPIXBZSA-N

mass

  • 416.382

monoisotopicmass

  • 416.11073

smiles

  • O=C1C2=C(C=C(/C=C/C(=O)O)OC2)C[C@@H]([C@@]1(O)C)OC(=O)C3=C(O)C=C(O)C=C3C

subset

  • 2_STAR

synonym EXACT

  • (E)-3-[(6S,7S)-6-(2,4-dihydroxy-6-methylbenzoyl)oxy-7-hydroxy-7-methyl-8-oxo-5,6-dihydro-1H-isochromen-3-yl]prop-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:206459

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