CHEBI:35517 - 5β-cholestane

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5β-cholestane
ChEBI ID CHEBI:35517
ChEBI ASCII Name 5beta-cholestane
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C27H48
Net Charge 0
Average Mass 372.67002
Monoisotopic Mass 372.376
InChI InChI=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
InChIKey XIIAYQZJNBULGD-CJPSHIORSA-N
SMILES [H][C@@]12CCCC[C@]1(C)[C@@]1([H])CC[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])CC2)[C@H](C)CCCC(C)C
ChEBI Ontology
Outgoing 5β-cholestane (CHEBI:35517) is a cholestane (CHEBI:35516)
Incoming 2,22,25-trideoxyecdysone (CHEBI:19290) has parent hydride 5β-cholestane (CHEBI:35517)
2-deoxyecdysone (CHEBI:19566) has parent hydride 5β-cholestane (CHEBI:35517)
25-deoxyecdysone (CHEBI:19814) has parent hydride 5β-cholestane (CHEBI:35517)
3α,7α,12α,24-tetrahydroxy-5β-cholestan-26-oic acid (CHEBI:48742) has parent hydride 5β-cholestane (CHEBI:35517)
3α,7α,12α-trihydroxy-5β-cholestan-26-al (CHEBI:16466) has parent hydride 5β-cholestane (CHEBI:35517)
3α,7α,12α-trihydroxy-5β-cholestan-26-oic acid (CHEBI:18402) has parent hydride 5β-cholestane (CHEBI:35517)
3α,7α,24-trihydroxy-5β-cholestan-26-al (CHEBI:48734) has parent hydride 5β-cholestane (CHEBI:35517)
3α,7α,24-trihydroxy-5β-cholestan-26-oic acid (CHEBI:48736) has parent hydride 5β-cholestane (CHEBI:35517)
3α,7α-dihydroxy-5β-cholestan-26-al (CHEBI:27428) has parent hydride 5β-cholestane (CHEBI:35517)
3α,7α-dihydroxy-5β-cholestan-26-oic acid (CHEBI:16577) has parent hydride 5β-cholestane (CHEBI:35517)
3α,7β-dihydroxy-5β-cholest-24-en-26-oic acid (CHEBI:72727) has parent hydride 5β-cholestane (CHEBI:35517)
5β-cholest-7-ene (CHEBI:35866) has parent hydride 5β-cholestane (CHEBI:35517)
5β-cholestan-3-one (CHEBI:16074) has parent hydride 5β-cholestane (CHEBI:35517)
5β-cholestane-3α,7α,12α,24,26-pentol (CHEBI:48732) has parent hydride 5β-cholestane (CHEBI:35517)
5β-cholestane-3α,7α,12α,24-tetrol (CHEBI:48728) has parent hydride 5β-cholestane (CHEBI:35517)
5β-cholestane-3α,7α,12α,26-tetrol (CHEBI:17278) has parent hydride 5β-cholestane (CHEBI:35517)
5β-cholestane-3α,7α,12α-triol (CHEBI:16496) has parent hydride 5β-cholestane (CHEBI:35517)
5β-cholestane-3α,7α,24,26-tetrol (CHEBI:48731) has parent hydride 5β-cholestane (CHEBI:35517)
5β-cholestane-3α,7α,24-triol (CHEBI:48700) has parent hydride 5β-cholestane (CHEBI:35517)
5β-cholestane-3α,7α,26-triol (CHEBI:28540) has parent hydride 5β-cholestane (CHEBI:35517)
5β-cholestane-3α,7α-diol (CHEBI:28047) has parent hydride 5β-cholestane (CHEBI:35517)
5β-cyprinol (CHEBI:37913) has parent hydride 5β-cholestane (CHEBI:35517)
5β-scymnol (CHEBI:50106) has parent hydride 5β-cholestane (CHEBI:35517)
5,6β-epoxy-5β-cholestan-3β-ol (CHEBI:28164) has parent hydride 5β-cholestane (CHEBI:35517)
5,6β-epoxy-5β-cholestane (CHEBI:28033) has parent hydride 5β-cholestane (CHEBI:35517)
7α,12α,24-trihydroxy-5β-cholestan-3-one (CHEBI:48715) has parent hydride 5β-cholestane (CHEBI:35517)
7α,12α,26-trihydroxy-5β-cholestan-3-one (CHEBI:48834) has parent hydride 5β-cholestane (CHEBI:35517)
7α,12α-dihydroxy-5β-cholestan-3-one (CHEBI:2288) has parent hydride 5β-cholestane (CHEBI:35517)
7α,24-dihydroxy-5β-cholestan-3-one (CHEBI:48698) has parent hydride 5β-cholestane (CHEBI:35517)
7α,26-dihydroxy-5β-cholestan-3-one (CHEBI:48778) has parent hydride 5β-cholestane (CHEBI:35517)
7α-hydroxy-5β-cholestan-3-one (CHEBI:2290) has parent hydride 5β-cholestane (CHEBI:35517)
coprostanol (CHEBI:89519) has parent hydride 5β-cholestane (CHEBI:35517)
ecdysone (CHEBI:16688) has parent hydride 5β-cholestane (CHEBI:35517)
IUPAC Name
5β-cholestane
Synonyms Sources
(5β)-cholestane ChEBI
β-cholestane NIST Chemistry WebBook
coprostane NIST Chemistry WebBook
pseudocholestane NIST Chemistry WebBook
Manual Xref Database
LMST01010085 LIPID MAPS
View more database links
Registry Numbers Types Sources
2051807 Beilstein Registry Number Beilstein
481-20-9 CAS Registry Number NIST Chemistry WebBook
Last Modified
24 March 2017