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CHEBI:52973 - ergosteryl 3-β-D-glucoside

Default Structure
ChEBI IDCHEBI:52973
ChEBI Nameergosteryl 3-β-D-glucoside
Stars
ASCII Nameergosteryl 3-beta-D-glucoside
DefinitionThe ergosterol analogue of a sterol 3-β-D-glucoside.
Last Modified1 October 2019
Submitterkieran
DownloadsMolfile
FormulaC34H54O6
Net Charge0
Average Mass558.800
Monoisotopic Mass558.39204
SMILES[H][C@@]12CC[C@]([H])([C@H](C)/C=C/[C@H](C)C(C)C)[C@@]1(C)CC[C@@]1([H])C2=CC=C2C[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@@]21C
InChIInChI=1S/C34H54O6/c1-19(2)20(3)7-8-21(4)25-11-12-26-24-10-9-22-17-23(13-15-33(22,5)27(24)14-16-34(25,26)6)39-32-31(38)30(37)29(36)28(18-35)40-32/h7-10,19-21,23,25-32,35-38H,11-18H2,1-6H3/b8-7+/t20-,21+,23-,25+,26-,27-,28+,29+,30-,31+,32+,33-,34+/m0/s1
InChIKeyMKZPNGBJJJZJMI-GBLVNJONSA-N
Species of MetaboliteComponentSourceComments
Cordyceps sinensis (ncbitaxon:72228) mycelium (BTO:0001436) PubMed (21848266) Ethanolic extract of dried mycelia
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Biological Roles:
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
ergosteryl 3-β-D-glucoside (CHEBI:52973) has functional parent ergosterol (CHEBI:16933)
ergosteryl 3-β-D-glucoside (CHEBI:52973) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
ergosteryl 3-β-D-glucoside (CHEBI:52973) has role metabolite (CHEBI:25212)
ergosteryl 3-β-D-glucoside (CHEBI:52973) is a monosaccharide derivative (CHEBI:63367)
ergosteryl 3-β-D-glucoside (CHEBI:52973) is a sterol 3-β-D-glucoside (CHEBI:37424)
IUPAC Name 
(3β,22E)-ergosta-5,7,22-trien-3-yl β-D-glucopyranoside
UniProt Name  Source
ergosteryl 3-β-D-glucosideUniProt
Registry NumbersSources
Beilstein:66840Beilstein