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CHEBI:68073 - chrysogeside E

ChEBI IDCHEBI:68073
ChEBI Namechrysogeside E
Stars
DefinitionA glucosylceramide isolated from Penicillium chrysogenum.
Last Modified21 July 2016
DownloadsMolfile
FormulaC41H77NO9
Net Charge0
Average Mass728.065
Monoisotopic Mass727.55983
SMILESCCCCCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CC/C=C(\C)CCCCCC
InChIInChI=1S/C41H77NO9/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-20-24-29-35(45)40(49)42-33(31-50-41-39(48)38(47)37(46)36(30-43)51-41)34(44)28-25-21-23-27-32(3)26-22-9-7-5-2/h25,27-28,33-39,41,43-48H,4-24,26,29-31H2,1-3H3,(H,42,49)/b28-25+,32-27+/t33-,34+,35+,36+,37+,38-,39+,41+/m0/s1
InChIKeyAXAOTVYUULFFTE-FRJHFHMPSA-N
Species of MetaboliteComponentSourceComments
Penicillium chrysogenum (ncbitaxon:5076) mycelium (BTO:0001436) PubMed (21381678) Fungus isolated from the root surface of Rhizophora stylosa, EtOAc extract of fermentation broth Strain: PXP 55
Roles Classification
Biological Role:
Penicillium metabolite  Any fungal metabolite produced during a metabolic reaction in Penicillium.
ChEBI Ontology
Outgoing Relation(s)
chrysogeside E (CHEBI:68073) has role Penicillium metabolite (CHEBI:76964)
chrysogeside E (CHEBI:68073) is a β-D-glucosylceramide (CHEBI:83264)
IUPAC Name 
(2R)-N-[(2S,3R,4E,8E)-1-(β-D-glucopyranosyloxy)-3-hydroxy-9-methylpentadeca-4,8-dien-2-yl]-2-hydroxynonadecanamide
Registry NumbersSources
Reaxys:21559831Reaxys
Citations