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Concept information

Preferred term

Euphoractine W از S.guyanensis  

Type

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

charge

  • 0

formula

  • C22H30O6

inchi

  • InChI=1S/C22H30O6/c1-9-15(24)12-13(16(9)25)19(28-10(2)23)21(5)8-7-11-14(18(27)20(11,3)4)22(21,6)17(12)26/h9,11,14-15,18-19,24,27H,7-8H2,1-6H3/t9-,11-,14-,15-,18+,19-,21+,22+/m0/s1

inchikey

  • LGKDMGOZBYXQGC-MDZYDEJXSA-N

mass

  • 390.476

monoisotopicmass

  • 390.20424

smiles

  • O[C@@H]1[C@@]2([C@@](C1(C)C)(CC[C@]3([C@]2(C(=O)C4=C([C@@H]3OC(=O)C)C(=O)[C@H]([C@@H]4O)C)C)C)[H])[H]

subset

  • 2_STAR

synonym EXACT

  • [(1S,2R,5S,6S,9S,10R,11R,13S)-6,11-dihydroxy-1,5,9,12,12-pentamethyl-4,8-dioxo-2-tetracyclo[7.6.0.03,7.010,13]pentadec-3(7)-enyl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:182338

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