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Concept information

Preferred term

24-hydroxychola-4-ene-3-one  

Type

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

Broader concept

charge

  • 0

formula

  • C24H38O2

inchi

  • InChI=1S/C24H38O2/c1-16(5-4-14-25)20-8-9-21-19-7-6-17-15-18(26)10-12-23(17,2)22(19)11-13-24(20,21)3/h15-16,19-22,25H,4-14H2,1-3H3/t16-,19+,20-,21+,22+,23+,24-/m1/s1

inchikey

  • QJKBUSGUNXZSRG-SVYVOUITSA-N

mass

  • 358.566

monoisotopicmass

  • 358.28718

smiles

  • O=C1CC[C@@]2([C@@]3([C@]([C@]4([C@@]([C@](CC4)([C@@H](CCCO)C)[H])(CC3)C)[H])(CCC2=C1)[H])[H])C

subset

  • 2_STAR

synonym EXACT

  • (8S,9S,10R,13R,14S,17R)-17-[(2R)-5-hydroxypentan-2-yl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:181791

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