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Concept information

Preferred term

انتروسین  

Type

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

Broader concept

charge

  • 0

formula

  • C22H20O10

inchi

  • InChI=1S/C22H20O10/c1-30-11-7-12(31-14(23)8-11)16-20(27)9-13-18(25)21(16,28)17(22(20,29)19(26)32-13)15(24)10-5-3-2-4-6-10/h2-8,13,16-18,25,27-29H,9H2,1H3/t13-,16-,17+,18-,20-,21+,22-/m1/s1

inchikey

  • CTBBEXWJRAPJIZ-VHPBLNRZSA-N

mass

  • 444.392

monoisotopicmass

  • 444.10565

smiles

  • O=C1OC(=CC(=C1)OC)[C@H]2[C@@]3(O)[C@H](O)[C@@H]4OC([C@]([C@@]2(O)C4)(O)[C@H]3C(=O)C5=CC=CC=C5)=O

subset

  • 2_STAR

synonym EXACT

  • (1S,2S,3S,6R,8R,9S,10R)-2-benzoyl-1,3,8,10-tetrahydroxy-9-(4-methoxy-6-oxopyran-2-yl)-5-oxatricyclo[4.3.1.03,8]decan-4-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209769

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