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CHEBI:228372 - (9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol

ChEBI IDCHEBI:228372
ChEBI Name(9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol
Stars
ASCII Name(9xi,14xi,25S)-cholestane-3beta,4beta,6beta,7alpha,8,15alpha,16beta,26-octol
Last Modified4 January 2024
SubmitterAdnan
DownloadsMolfile
FormulaC27H48O8
Net Charge0
Average Mass500.673
Monoisotopic Mass500.33492
SMILES[H][C@]1([C@H](C)CCC[C@H](C)CO)[C@@H](O)[C@H](O)C2[C@@]3(O)C(CC[C@@]21C)[C@@]1(C)CC[C@H](O)[C@H](O)C1[C@H](O)[C@H]3O
InChIInChI=1S/C27H48O8/c1-13(12-28)6-5-7-14(2)17-20(31)22(33)23-26(17,4)11-9-16-25(3)10-8-15(29)19(30)18(25)21(32)24(34)27(16,23)35/h13-24,28-35H,5-12H2,1-4H3/t13-,14+,15-,16?,17-,18?,19-,20+,21-,22-,23?,24+,25+,26+,27-/m0/s1
InChIKeyVYOXQPQXOVKJIA-NMTBNCKFSA-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:
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
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,4β,6β,7α,8,15α,16β,26-octol (CHEBI:228372) has role animal metabolite (CHEBI:75767)
(9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol (CHEBI:228372) has role antifungal agent (CHEBI:35718)
(9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol (CHEBI:228372) has role marine metabolite (CHEBI:76507)
(9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol (CHEBI:228372) is a 15α-hydroxy steroid (CHEBI:83147)
(9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol (CHEBI:228372) is a 16β-hydroxy steroid (CHEBI:17354)
(9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol (CHEBI:228372) is a 26-hydroxy steroid (CHEBI:36852)
(9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol (CHEBI:228372) is a 3β-hydroxy steroid (CHEBI:36836)
(9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol (CHEBI:228372) is a 4-hydroxy steroid (CHEBI:62846)
(9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol (CHEBI:228372) is a 6β-hydroxy steroid (CHEBI:36851)
(9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol (CHEBI:228372) is a 7α-hydroxy steroid (CHEBI:36843)
(9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol (CHEBI:228372) is a 8-hydroxy steroid (CHEBI:139333)
IUPAC Name 
(9ξ,14ξ,25S)-cholestane-3β,4β,6β,7α,8,15α,16β,26-octol