CHEBI:50108 - 5α-cholane-3α,7α,12α,24-tetrol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5α-cholane-3α,7α,12α,24-tetrol
ChEBI ID CHEBI:50108
ChEBI ASCII Name 5alpha-cholane-3alpha,7alpha,12alpha,24-tetrol
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C24H42O4
Net Charge 0
Average Mass 394.58788
Monoisotopic Mass 394.30831
InChI InChI=1S/C24H42O4/c1-14(5-4-10-25)17-6-7-18-22-19(13-21(28)24(17,18)3)23(2)9-8-16(26)11-15(23)12-20(22)27/h14-22,25-28H,4-13H2,1-3H3/t14-,15-,16-,17-,18+,19+,20-,21+,22+,23+,24-/m1/s1
InChIKey BMSROUVLRAQRBY-JLIFGLSWSA-N
SMILES [H][C@]12C[C@H](O)CC[C@]1(C)[C@@]1([H])C[C@H](O)[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])[C@H](O)C2)[C@H](C)CCCO
ChEBI Ontology
Outgoing 5α-cholane-3α,7α,12α,24-tetrol (CHEBI:50108) has parent hydride 5α-cholane (CHEBI:20642)
5α-cholane-3α,7α,12α,24-tetrol (CHEBI:50108) is a 12α-hydroxy steroid (CHEBI:36846)
5α-cholane-3α,7α,12α,24-tetrol (CHEBI:50108) is a 24-hydroxy steroid (CHEBI:36865)
5α-cholane-3α,7α,12α,24-tetrol (CHEBI:50108) is a 3α-hydroxy steroid (CHEBI:36835)
5α-cholane-3α,7α,12α,24-tetrol (CHEBI:50108) is a 7α-hydroxy steroid (CHEBI:36843)
Incoming 3α,7α,12α-trihydroxy-5α-cholan-24-yl sulfate (CHEBI:50109) has functional parent 5α-cholane-3α,7α,12α,24-tetrol (CHEBI:50108)
Synonyms Sources
5alpha-Cholan-3alpha,7alpha,12alpha,24-tetrol KEGG COMPOUND
5α-cholane-3α,7α,12α,24-tetrol UniProt
Petromyzonol KEGG COMPOUND
Manual Xrefs Databases
C16258 KEGG COMPOUND
LMST04010301 LIPID MAPS
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Registry Number Type Source
5965024 Beilstein Registry Number Beilstein
Last Modified
22 September 2016