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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > sapogenin > tigogenin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > sapogenin > tigogenin
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > sapogenin > tigogenin
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > sapogenin > tigogenin

Preferred term

tigogenin  

Type

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

Broader concept

charge

  • 0

formula

  • C27H44O3

has_role

inchi

  • InChI=1S/C27H44O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28H,5-15H2,1-4H3/t16-,17+,18+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1

inchikey

  • GMBQZIIUCVWOCD-MFRNJXNGSA-N

mass

  • 416.646

monoisotopicmass

  • 416.32905

smiles

  • [H][C@]12C[C@@]3([H])[C@]4([H])CC[C@@]5([H])C[C@@H](O)CC[C@]5(C)[C@@]4([H])CC[C@]3(C)[C@@]1([H])[C@H](C)[C@@]1(CC[C@@H](C)CO1)O2

subset

  • 3_STAR

synonym EXACT

  • (25R)-5alpha-spirostan-3beta-ol
  • tigogenin

synonym RELATED

  • (3-beta,5alpha,25R)-spirostan-3-ol
  • (5alpha,25R)-spirostan-3beta-ol
  • 5-epi-sarsasapogenin

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:9595

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