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Concept information

Preferred term

فوساکندین بی  

Type

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

Broader concept

charge

  • 0

formula

  • C41H60O20

inchi

  • InChI=1S/C41H60O20/c1-2-3-4-5-6-7-9-12-22(46)13-10-8-11-14-28(49)59-38-35(55)37(29-21(17-42)15-23(47)16-24(29)48)56-27(20-45)36(38)60-41-39(33(53)31(51)26(19-44)58-41)61-40-34(54)32(52)30(50)25(18-43)57-40/h6-12,14-16,22,25-27,30-48,50-55H,2-5,13,17-20H2,1H3/b7-6+,10-8+,12-9+,14-11+/t22?,25-,26-,27-,30+,31+,32+,33+,34-,35+,36-,37+,38-,39-,40+,41+/m1/s1

inchikey

  • DEPSCDXHCFJSQZ-QICRFORPSA-N

mass

  • 872.911

monoisotopicmass

  • 872.36779

smiles

  • O=C(O[C@H]1[C@H](O[C@@H]2O[C@@H]([C@H](O)[C@@H]([C@H]2O[C@@H]3O[C@@H]([C@H](O)[C@@H]([C@H]3O)O)CO)O)CO)[C@H](O[C@H]([C@@H]1O)C4=C(O)C=C(O)C=C4CO)CO)/C=C/C=C/CC(O)/C=C/C=C/CCCCC

subset

  • 2_STAR

synonym EXACT

  • [(2S,3S,4R,5R,6R)-2-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxy-6-(hydroxymethyl)oxan-4-yl] (2E,4E,8E,10E)-7-hydroxyhexadeca-2,4,8,10-tetraenoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:216332

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