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CHEBI:68071 - chrysogeside C

ChEBI IDCHEBI:68071
ChEBI Namechrysogeside C
Stars
DefinitionA glucosylceramide isolated from Penicillium chrysogenum.
Last Modified21 July 2016
DownloadsMolfile
FormulaC40H73NO9
Net Charge0
Average Mass712.022
Monoisotopic Mass711.52853
SMILESCCCCCCCCCCCCCCC/C=C/[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)CCCCC
InChIInChI=1S/C40H73NO9/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-23-28-34(44)39(48)41-32(30-49-40-38(47)37(46)36(45)35(29-42)50-40)33(43)27-24-20-22-26-31(3)25-21-7-5-2/h23-24,26-28,32-38,40,42-47H,4-22,25,29-30H2,1-3H3,(H,41,48)/b27-24+,28-23+,31-26+/t32-,33+,34+,35+,36+,37-,38+,40+/m0/s1
InChIKeyMPDYYYVKKXHAGJ-JAKQRLLBSA-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 C (CHEBI:68071) has role Penicillium metabolite (CHEBI:76964)
chrysogeside C (CHEBI:68071) is a β-D-glucosylceramide (CHEBI:83264)
IUPAC Name 
(2R,3E)-N-[(2S,3R,4E,8E)-1-(β-D-glucopyranosyloxy)-3-hydroxy-9-methyltetradeca-4,8-dien-2-yl]-2-hydroxynonadec-3-enamide
Registry NumbersSources
Reaxys:21559829Reaxys
Citations