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Concept information

Preferred term

sumalarin c  

Type

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

Broader concept

charge

  • 0

formula

  • C19H24O8S

inchi

  • InChI=1S/C19H24O8S/c1-10-3-2-4-13(28-9-16(23)19(25)26)8-15(22)18-11(6-17(24)27-10)5-12(20)7-14(18)21/h5,7,10,13,16,20-21,23H,2-4,6,8-9H2,1H3,(H,25,26)/t10-,13-,16+/m0/s1

inchikey

  • XQMZRINLFAOTEN-YNZJMPHRSA-N

mass

  • 412.450

monoisotopicmass

  • 412.11919

smiles

  • S([C@@H]1CC(=O)C2=C(O)C=C(O)C=C2CC(=O)O[C@H](CCC1)C)C[C@@H](O)C(=O)O

subset

  • 2_STAR

synonym EXACT

  • (2S)-3-[[(5S,9S)-13,15-dihydroxy-5-methyl-3,11-dioxo-4-oxabicyclo[10.4.0]hexadeca-1(12),13,15-trien-9-yl]sulanyl]-2-hydroxypropanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204854

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