(9xi,14xi,25S)-cholestane-3beta,4beta,6beta,7alpha,8,15alpha,16beta,26-octol (CHEBI:228372)

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

ChEBI ID	CHEBI: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 Modified	4 January 2024
Submitter	Adnan
Downloads	Molfile

Formula	C27H48O8
Net Charge	0
Average Mass	500.673
Monoisotopic Mass	500.33492
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
InChI	InChI=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
InChIKey	VYOXQPQXOVKJIA-NMTBNCKFSA-N

Species of Metabolite	Component	Source	Comments
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.

antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.

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