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CHEBI:228369 - (9ξ,14ξ,25S)-cholestane-3β,6α,8,15α,16β,26-hexol

ChEBI IDCHEBI:228369
ChEBI Name(9ξ,14ξ,25S)-cholestane-3β,6α,8,15α,16β,26-hexol
Stars
ASCII Name(9xi,14xi,25S)-cholestane-3beta,6alpha,8,15alpha,16beta,26-hexol
Last Modified4 January 2024
SubmitterAdnan
DownloadsMolfile
FormulaC27H48O6
Net Charge0
Average Mass468.675
Monoisotopic Mass468.34509
SMILES[H][C@]1([C@H](C)CCC[C@H](C)CO)[C@@H](O)[C@H](O)C2[C@]3(O)C[C@H](O)C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C
InChIInChI=1S/C27H48O6/c1-15(14-28)6-5-7-16(2)21-22(31)23(32)24-26(21,4)11-9-20-25(3)10-8-17(29)12-18(25)19(30)13-27(20,24)33/h15-24,28-33H,5-14H2,1-4H3/t15-,16+,17-,18?,19-,20?,21-,22+,23-,24?,25-,26+,27-/m0/s1
InChIKeyJBQJBUSSZCBEON-OGHZAKTOSA-N
Species of MetaboliteComponentSourceComments
Rosaster (ncbitaxon:556858) Whole Organism (NCIT:C13413) Article (Bruno I., Minale, L., and Riccio, R., and La Barre, S. & Laurent, D. (1990) Isolation and structure of new polyhydroxylated sterols from a deep-water starfish of the genus Rosaster. Gazzetta Chimica Italiana, 120, 449-451.)
Roles Classification
Biological Roles:
marine metabolite  Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
animal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
ChEBI Ontology
Outgoing Relation(s)
(9ξ,14ξ,25S)-cholestane-3β,6α,8,15α,16β,26-hexol (CHEBI:228369) has role animal metabolite (CHEBI:75767)
(9ξ,14ξ,25S)-cholestane-3β,6α,8,15α,16β,26-hexol (CHEBI:228369) has role marine metabolite (CHEBI:76507)
(9ξ,14ξ,25S)-cholestane-3β,6α,8,15α,16β,26-hexol (CHEBI:228369) is a 15α-hydroxy steroid (CHEBI:83147)
(9ξ,14ξ,25S)-cholestane-3β,6α,8,15α,16β,26-hexol (CHEBI:228369) is a 16β-hydroxy steroid (CHEBI:17354)
(9ξ,14ξ,25S)-cholestane-3β,6α,8,15α,16β,26-hexol (CHEBI:228369) is a 26-hydroxy steroid (CHEBI:36852)
(9ξ,14ξ,25S)-cholestane-3β,6α,8,15α,16β,26-hexol (CHEBI:228369) is a 3β-hydroxy steroid (CHEBI:36836)
(9ξ,14ξ,25S)-cholestane-3β,6α,8,15α,16β,26-hexol (CHEBI:228369) is a 6α-hydroxy steroid (CHEBI:36850)
(9ξ,14ξ,25S)-cholestane-3β,6α,8,15α,16β,26-hexol (CHEBI:228369) is a 8-hydroxy steroid (CHEBI:139333)
Incoming Relation(s)
(25S)-5alpha-cholestan-3beta,6alpha,8beta,15alpha,16beat,26-hexol (CHEBI:193403) is a (9ξ,14ξ,25S)-cholestane-3β,6α,8,15α,16β,26-hexol (CHEBI:228369)
IUPAC Name 
(9ξ,14ξ,25S)-cholestane-3β,6α,8,15α,16β,26-hexol