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CHEBI:211335 - 7-O-acetylcytochalasin P

ChEBI IDCHEBI:211335
ChEBI Name7-O-acetylcytochalasin P
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H41NO8
Net Charge0
Average Mass567.679
Monoisotopic Mass567.28322
SMILESCC(=O)O[C@H]1[C@@H]2/C=C/C[C@H](C)C(=O)[C@](C)(O)/C=C/[C@@H](OC(C)=O)[C@]23C(=O)N[C@@H](Cc2ccccc2)[C@@H]3[C@H](C)[C@@]1(C)O
InChIInChI=1S/C32H41NO8/c1-18-11-10-14-23-28(41-21(4)35)31(6,39)19(2)26-24(17-22-12-8-7-9-13-22)33-29(37)32(23,26)25(40-20(3)34)15-16-30(5,38)27(18)36/h7-10,12-16,18-19,23-26,28,38-39H,11,17H2,1-6H3,(H,33,37)/b14-10+,16-15+/t18-,19-,23-,24-,25+,26-,28-,30+,31+,32+/m0/s1
InChIKeySBNCVVKUVDSTKZ-BGEAZSDNSA-N
Species of MetaboliteComponentSourceComments
Xylaria longipes (ncbitaxon:114818) - PubMed (31351910)
Roles Classification
Biological Roles:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
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)
7-O-acetylcytochalasin P (CHEBI:211335) is a cytochalasan alkaloid (CHEBI:75946)
IUPAC Name 
[(1R,2R,3E,5R,7S,9E,11R,12S,13R,14S,15R,16S)-12-acetyloxy-16-benzyl-5,13-dihydroxy-5,7,13,14-tetramethyl-6,18-dioxo-17-azatricyclo[9.7.0.01,15]octadeca-3,9-dien-2-yl] acetate