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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > cardanolide glycoside > 20,22-dihydrodigoxin
organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > cardanolide glycoside > 20,22-dihydrodigoxin

Preferred term

20,22-dihydrodigoxin  

Type

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

Broader concept

charge

  • 0

formula

  • C41H66O14

has_functional_parent

has_role

inchi

  • InChI=1S/C41H66O14/c1-19-36(47)28(42)15-34(50-19)54-38-21(3)52-35(17-30(38)44)55-37-20(2)51-33(16-29(37)43)53-24-8-10-39(4)23(13-24)6-7-26-27(39)14-31(45)40(5)25(9-11-41(26,40)48)22-12-32(46)49-18-22/h19-31,33-38,42-45,47-48H,6-18H2,1-5H3/t19-,20-,21-,22?,23-,24+,25-,26-,27+,28+,29+,30+,31-,33+,34+,35+,36-,37-,38-,39+,40+,41+/m1/s1

inchikey

  • QYVJGQUFXQMOOE-WAFGNDRNSA-N

mass

  • 782.95430

monoisotopicmass

  • 782.44526

smiles

  • [H][C@]12CC[C@]3([H])[C@]([H])(C[C@@H](O)[C@]4(C)[C@]([H])(CC[C@]34O)C3COC(=O)C3)[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]-12beta,14-dihydroxy-5beta-cardanolide

synonym RELATED

  • dihydrodigoxin
  • Dihydrodigoxin

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:71002

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