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CHEBI:35515 - 5α-cholestane

ChEBI IDCHEBI:35515
ChEBI Name5α-cholestane
Stars
ASCII Name5alpha-cholestane
DefinitionThe 5α-stereoisomer of cholestane.
Secondary ChEBI IDCHEBI:20650
Last Modified14 March 2018
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC27H48
Net Charge0
Average Mass372.681
Monoisotopic Mass372.37560
SMILES[H][C@]12CCCC[C@]1(C)[C@@]1([H])CC[C@@]3(C)[C@@]([H])(CC[C@]3([H])[C@H](C)CCCC(C)C)[C@]1([H])CC2
InChIInChI=1S/C27H48/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h19-25H,6-18H2,1-5H3/t20-,21-,22+,23-,24+,25+,26+,27-/m1/s1
InChIKeyXIIAYQZJNBULGD-XWLABEFZSA-N
ChEBI Ontology
Outgoing Relation(s)
5α-cholestane (CHEBI:35515) is a cholestane (CHEBI:35516)
Incoming Relation(s)
(5α)-cholestan-3β-ol (CHEBI:86570) has parent hydride 5α-cholestane (CHEBI:35515)
26,27-dehydrozymosterol (CHEBI:136770) has parent hydride 5α-cholestane (CHEBI:35515)
3β-hydroxy-4α-methyl-5α-cholest-7-ene-4β-carboxylic acid (CHEBI:20244) has parent hydride 5α-cholestane (CHEBI:35515)
3β-hydroxy-4β-methyl-5α-cholest-7-ene-4α-carboxylic acid (CHEBI:18134) has parent hydride 5α-cholestane (CHEBI:35515)
4,4-dimethyl-5α-cholesta-8,14,24-trien-3β-ol (CHEBI:17813) has parent hydride 5α-cholestane (CHEBI:35515)
4α-methyllathosterone (CHEBI:16495) has parent hydride 5α-cholestane (CHEBI:35515)
5,6α-epoxy-5α-cholestan-3β-ol (CHEBI:49305) has parent hydride 5α-cholestane (CHEBI:35515)
5,6α-epoxy-5α-cholestane (CHEBI:27634) has parent hydride 5α-cholestane (CHEBI:35515)
5,6β-epoxy-5α-cholestan-3β-ol (CHEBI:28344) has parent hydride 5α-cholestane (CHEBI:35515)
5α-cholest-7-ene (CHEBI:35865) has parent hydride 5α-cholestane (CHEBI:35515)
5α-cholest-8-en-3β-ol (CHEBI:16608) has parent hydride 5α-cholestane (CHEBI:35515)
5α-cholesta-7,24-dien-3β-ol (CHEBI:16290) has parent hydride 5α-cholestane (CHEBI:35515)
5α-cholesta-8,14-dien-3β-ol (CHEBI:86131) has parent hydride 5α-cholestane (CHEBI:35515)
5α-cholestan-3-one (CHEBI:17762) has parent hydride 5α-cholestane (CHEBI:35515)
5α-cholestane-3β,5,6β-triol (CHEBI:28082) has parent hydride 5α-cholestane (CHEBI:35515)
5α-cholestane-5,6β-diol (CHEBI:27556) has parent hydride 5α-cholestane (CHEBI:35515)
eurysterol A (CHEBI:65888) has parent hydride 5α-cholestane (CHEBI:35515)
eurysterol A sulfonic acid (CHEBI:68591) has parent hydride 5α-cholestane (CHEBI:35515)
eurysterol B (CHEBI:65889) has parent hydride 5α-cholestane (CHEBI:35515)
eurysterol B sulfonic acid (CHEBI:68594) has parent hydride 5α-cholestane (CHEBI:35515)
fusidic acid (CHEBI:29013) has parent hydride 5α-cholestane (CHEBI:35515)
methyl spongoate (CHEBI:68388) has parent hydride 5α-cholestane (CHEBI:35515)
zymosterol (CHEBI:18252) has parent hydride 5α-cholestane (CHEBI:35515)
zymosterone (CHEBI:52386) has parent hydride 5α-cholestane (CHEBI:35515)
epidihydrocholesterin (CHEBI:31542) is a 5α-cholestane (CHEBI:35515)
IUPAC Name 
5α-cholestane
Synonyms  Source
α-cholestaneNIST Chemistry WebBook
(5α)-cholestaneNIST Chemistry WebBook
Manual XrefsDatabases
HMDB0041632HMDB
Registry NumbersSources
Reaxys:2051806Reaxys
CAS:481-21-0ChemIDplus
CAS:481-21-0NIST Chemistry WebBook