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Concept information

organooxygen compound > ester > lactone > steroid lactone > calcitriol 26,23-lactone
organooxygen compound > oxacycle > lactone > steroid lactone > calcitriol 26,23-lactone

Preferred term

calcitriol 26,23-lactone  

Type

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

Broader concept

charge

  • 0

formula

  • C27H40O5

has_functional_parent

inchi

  • InChI=1S/C27H40O5/c1-16(12-21-15-27(4,31)25(30)32-21)22-9-10-23-18(6-5-11-26(22,23)3)7-8-19-13-20(28)14-24(29)17(19)2/h7-8,16,20-24,28-29,31H,2,5-6,9-15H2,1,3-4H3/b18-7+,19-8-/t16-,20-,21?,22-,23+,24+,26-,27?/m1/s1

inchikey

  • WMYIVSWWSRCZFA-DKRDSXHXSA-N

mass

  • 444.60350

monoisotopicmass

  • 444.28757

smiles

  • [H][C@@]1(CC[C@@]2([H])/C(CCC[C@]12C)=C/C=C1/C[C@@H](O)C[C@H](O)C1=C)[C@H](C)CC1CC(C)(O)C(=O)O1

subset

  • 3_STAR

synonym EXACT

  • (1S,3R,5Z,7E)-1,3,25-trihydroxy-9,10-secocholesta-5,7,10-trieno-26,23-lactone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:47837

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