EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:218969 - Cytochalasin Z15

ChEBI IDCHEBI:218969
ChEBI NameCytochalasin Z15
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H33NO5
Net Charge0
Average Mass427.541
Monoisotopic Mass427.23587
SMILESCC(=O)[C@H](O)[C@@H](C)C/C=C/[C@H]1[C@H](O)C(C)=C(C)[C@H]2[C@H](Cc3ccccc3)NC(=O)[C@@]12O
InChIInChI=1S/C25H33NO5/c1-14(22(28)17(4)27)9-8-12-19-23(29)16(3)15(2)21-20(26-24(30)25(19,21)31)13-18-10-6-5-7-11-18/h5-8,10-12,14,19-23,28-29,31H,9,13H2,1-4H3,(H,26,30)/b12-8+/t14-,19-,20-,21-,22+,23+,25+/m0/s1
InChIKeyRQWVQCYJRCZFED-LYRHPEFXSA-N
Species of MetaboliteComponentSourceComments
Mariannaea elegans (ncbitaxon:509241) - PubMed (18507474)
ChEBI Ontology
Outgoing Relation(s)
Cytochalasin Z15 (CHEBI:218969) is a isoindoles (CHEBI:24897)
IUPAC Name 
(3S,3aS,6S,7S,7aS)-3-benzyl-6,7a-dihydroxy-7-[(E,4S,5R)-5-hydroxy-4-methyl-6-oxohept-1-enyl]-4,5-dimethyl-3,3a,6,7-tetrahydro-2H-isoindol-1-one
Manual XrefsDatabases
23329860ChemSpider