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Concept information

کاردنولید گلیکوزید > دیجیتوکسین

Preferred term

دیجیتوکسین  

Type

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

Broader concept

alt_id

  • CHEBI:23728
  • CHEBI:4549

charge

  • 0

formula

  • C41H64O13

has_functional_parent

has_role

inchi

  • InChI=1S/C41H64O13/c1-20-36(46)29(42)16-34(49-20)53-38-22(3)51-35(18-31(38)44)54-37-21(2)50-33(17-30(37)43)52-25-8-11-39(4)24(15-25)6-7-28-27(39)9-12-40(5)26(10-13-41(28,40)47)23-14-32(45)48-19-23/h14,20-22,24-31,33-38,42-44,46-47H,6-13,15-19H2,1-5H3/t20-,21-,22-,24-,25+,26-,27+,28-,29+,30+,31+,33+,34+,35+,36-,37-,38-,39+,40-,41+/m1/s1

inchikey

  • WDJUZGPOPHTGOT-XUDUSOBPSA-N

is_conjugate_acid_of

mass

  • 764.93910

monoisotopicmass

  • 764.43469

smiles

  • [H][C@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@]([H])(CC[C@]34O)C3=CC(=O)OC3)[C@@]1(C)CC[C@@H](C2)O[C@H]1C[C@H](O)[C@H](O[C@H]2C[C@H](O)[C@H](O[C@H]3C[C@H](O)[C@H](O)[C@@H](C)O3)[C@@H](C)O2)[C@@H](C)O1

subset

  • 3_STAR

synonym EXACT

  • 3beta-[2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyloxy]-14-hydroxy-5beta-card-20(22)-enolide
  • Digitoxin

synonym RELATED

  • Crystodigin (TN)
  • Digitoxoside

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:28544

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