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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > cholanoid > isodeoxycholic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > cholanoid > isodeoxycholic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > cholanoid > isodeoxycholic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > cholanoid > isodeoxycholic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > cholanoid > isodeoxycholic acid

Preferred term

isodeoxycholic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C24H40O4

inchi

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

inchikey

  • ZHCAAZIHTDCFJX-QLEQUTGBSA-N

mass

  • 392.573

monoisotopicmass

  • 392.29266

smiles

  • C1CC[C@@]2([C@](C1)([C@@]3([C@@]([C@@H](C2)O)([C@]4([C@]([C@H](C3)O)([C@](CC4)([C@H](C)CCC(O)=O)[H])C)[H])[H])[H])C)[H]

subset

  • 2_STAR

synonym EXACT

  • Isodeoxycholic acid

synonym RELATED

  • 3-Deoxycholic acid
  • (4R)-4-[(1S,2S,7S,9R,10R,11S,14R,15R,16S)-9,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]pentanoic acid
  • 7a,12a-Dihydroxy-5b-Cholan-24-oate
  • 7a,12a-Dihydroxy-5b-Cholan-24-oic acid
  • 7a,12a-Dihydroxy-5b-cholanic acid
  • 7a,12a-Dihydroxy-5b-cholanoate
  • 7a,12a-Dihydroxy-5b-cholanoic acid
  • 7a,12a-Dihydroxycholanoate
  • 7a,12a-Dihydroxycholanoic acid
  • 7alpha,12alpha-Dihydroxy-5beta-cholan-24-oate
  • 7alpha,12alpha-Dihydroxy-5beta-cholan-24-oic acid
  • 7alpha,12alpha-Dihydroxy-5beta-cholanic acid
  • 7alpha,12alpha-Dihydroxycholanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:81256

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