skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

25-hydroxy-24-oxocalciol  

Type

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

charge

  • 0

formula

  • C27H42O3

inchi

  • InChI=1S/C27H42O3/c1-18-8-12-22(28)17-21(18)11-10-20-7-6-16-27(5)23(13-14-24(20)27)19(2)9-15-25(29)26(3,4)30/h10-11,19,22-24,28,30H,1,6-9,12-17H2,2-5H3/b20-10+,21-11-/t19-,22+,23-,24+,27-/m1/s1

inchikey

  • DDZHNKIBJQESJA-AHMPPUFCSA-N

mass

  • 414.62058

monoisotopicmass

  • 414.31340

smiles

  • [H][C@@]1(CC[C@@]2([H])/C(CCC[C@]12C)=C/C=C1/C[C@@H](O)CCC1=C)[C@H](C)CCC(=O)C(C)(C)O

subset

  • 3_STAR

synonym EXACT

  • 25-hydroxy-24-oxocalciol
  • (3S,5Z,7E)-3,25-dihydroxy-9,10-secocholesta-5,7,10-trien-24-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:47805

Download this concept: