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CHEBI:67814 - Neurosporaside peracetate

ChEBI IDCHEBI:67814
ChEBI NameNeurosporaside peracetate
Stars
DefinitionA natural product found in Neurospora crassa.
Last Modified22 September 2014
DownloadsMolfile
FormulaC92H151NO38
Net Charge0
Average Mass1879.189
Monoisotopic Mass1877.99141
SMILES[H][C@]1(O[C@H]2[C@H](OC[C@H]3O[C@@H](OC[C@H]4O[C@@H](OC[C@H](NC(=O)[C@H](O)CCCCCCCCCCCCCCCCCCCCCC)[C@H](O)[C@H](O)CCCCCCCCCCCCCC)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]4OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]3OC(C)=O)O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O
InChIInChI=1S/C92H151NO38/c1-16-18-20-22-24-26-28-30-31-32-33-34-35-36-37-39-41-43-45-47-49-70(108)88(110)93-68(75(109)69(107)48-46-44-42-40-38-29-27-25-23-21-19-17-2)50-113-89-84(124-65(13)104)80(120-61(9)100)78(118-59(7)98)73(128-89)53-114-90-85(125-66(14)105)81(121-62(10)101)79(119-60(8)99)74(129-90)54-115-91-86(82(122-63(11)102)76(116-57(5)96)71(127-91)51-111-55(3)94)131-92-87(126-67(15)106)83(123-64(12)103)77(117-58(6)97)72(130-92)52-112-56(4)95/h68-87,89-92,107-109H,16-54H2,1-15H3,(H,93,110)/t68-,69+,70+,71+,72+,73+,74+,75-,76-,77+,78-,79-,80-,81-,82-,83-,84+,85+,86+,87+,89+,90+,91+,92+/m0/s1
InChIKeyBFMZDAHVXVLZEQ-FZOJFUJKSA-N
Species of MetaboliteComponentSourceComments
Neurospora crassa (ncbitaxon:5141) mycelium (BTO:0001436) PubMed (21425845) Lyophilized mycelia extracted with mixture of methanol and chloroform Strain: 74 OR23 1
Roles Classification
Biological Role:
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)
Neurosporaside peracetate (CHEBI:67814) has role metabolite (CHEBI:25212)
Neurosporaside peracetate (CHEBI:67814) is a glycosylceramide (CHEBI:62941)
Citations