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CHEBI:222379 - Cytochalasin Z5

ChEBI IDCHEBI:222379
ChEBI NameCytochalasin Z5
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SubmitterMetaboLights
DownloadsMolfile
FormulaC29H37NO6
Net Charge0
Average Mass495.616
Monoisotopic Mass495.26209
SMILESC=C1[C@@H](C)[C@H]2[C@H](Cc3ccc(O)cc3)NC(=O)[C@]23OC(=O)/C=C/[C@H](O)CCC[C@@H](C)C/C=C/[C@H]3[C@@H]1O
InChIInChI=1S/C29H37NO6/c1-17-6-4-8-21(31)14-15-25(33)36-29-23(9-5-7-17)27(34)19(3)18(2)26(29)24(30-28(29)35)16-20-10-12-22(32)13-11-20/h5,9-15,17-18,21,23-24,26-27,31-32,34H,3-4,6-8,16H2,1-2H3,(H,30,35)/b9-5+,15-14+/t17-,18-,21-,23+,24+,26+,27-,29-/m1/s1
InChIKeyAJMKPZXRIKVSAQ-LFOGIAMQSA-N
Species of MetaboliteComponentSourceComments
Boeremia exigua var. heteromorpha (ncbitaxon:749468) - PubMed (14695792)
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)
Cytochalasin Z5 (CHEBI:222379) is a cytochalasan alkaloid (CHEBI:75946)
IUPAC Name 
(1S,4E,6R,10R,12E,14S,15S,17S,18S,19S)-6,15-dihydroxy-19-[(4-hydroxyphenyl)methyl]-10,17-dimethyl-16-methylidene-2-oxa-20-azatricyclo[12.7.0.01,18]henicosa-4,12-diene-3,21-dione
Manual XrefsDatabases
10181895ChemSpider