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Concept information

Preferred term

gitoxigenin  

Type

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

charge

  • 0

formula

  • C23H34O5

has_parent_hydride

inchi

  • InChI=1S/C23H34O5/c1-21-7-5-15(24)10-14(21)3-4-17-16(21)6-8-22(2)20(13-9-19(26)28-12-13)18(25)11-23(17,22)27/h9,14-18,20,24-25,27H,3-8,10-12H2,1-2H3/t14-,15+,16+,17-,18+,20+,21+,22-,23+/m1/s1

inchikey

  • PVAMXWLZJKTXFW-VQMOFDJESA-N

mass

  • 390.51306

monoisotopicmass

  • 390.24062

smiles

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

subset

  • 3_STAR

synonym EXACT

  • 3beta,14,16beta-trihydroxy-5beta-card-20(22)-enolide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:38105

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