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Concept information

Preferred term

merochlorin f  

Type

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

Broader concept

charge

  • 0

formula

  • C26H33ClO5

inchi

  • InChI=1S/C26H33ClO5/c1-14(2)16(10-19-15(3)8-7-9-24(19,4)5)13-26(32)22(30)18-11-17(28)12-20(29)21(18)23(31)25(26,6)27/h8,11-12,19,28-29,32H,7,9-10,13H2,1-6H3/t19-,25+,26+/m0/s1

inchikey

  • QYGRDYUHWNHSEG-AFWDCEBSSA-N

mass

  • 461.000

monoisotopicmass

  • 460.20165

smiles

  • Cl[C@@]1(C(=O)C2=C(O)C=C(O)C=C2C([C@]1(O)CC(=C(C)C)C[C@H]3C(=CCCC3(C)C)C)=O)C

subset

  • 2_STAR

synonym EXACT

  • (2R,3S)-3-chloro-2,5,7-trihydroxy-3-methyl-2-[3-methyl-2-[[(1R)-2,6,6-trimethylcyclohex-2-en-1-yl]methyl]but-2-enyl]naphthalene-1,4-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209936

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