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Chemistry, part 1

Content language

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Concept information

Preferred term

allodeoxycholic acid  

Type

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

charge

  • 0

formula

  • C24H40O4

has_role

inchi

  • InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17+,18-,19+,20+,21+,23+,24-/m1/s1

inchikey

  • KXGVEGMKQFWNSR-WFTUMUMQSA-N

is_conjugate_acid_of

mass

  • 392.573

monoisotopicmass

  • 392.29266

smiles

  • C1[C@@]2([C@]3(C[C@@H]([C@]4([C@]([C@@]3(CC[C@]2(C[C@@H](C1)O)[H])[H])(CC[C@]4([H])[C@@H](CCC(O)=O)C)[H])C)O)[H])C

subset

  • 3_STAR

synonym EXACT

  • 3alpha,12alpha-dihydroxy-5alpha-cholan-24-oic acid

synonym RELATED

  • 3alpha,12alpha-Dihydroxy-5alpha-cholanoic acid
  • (3alpha,5alpha,12alpha)-3,12-dihydroxycholan-24-oic acid
  • 5alpha-Deoxycholic acid
  • 5alpha-deoxycholic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:81276

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