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CHEBI:219871 - Cytochalasin Z15E

ChEBI IDCHEBI:219871
ChEBI NameCytochalasin Z15E
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]2O[C@]2(C)[C@@H](C)[C@H]2[C@H](Cc3ccccc3)NC(=O)[C@]21O
InChIInChI=1S/C25H33NO5/c1-14(21(28)16(3)27)9-8-12-18-22-24(4,31-22)15(2)20-19(26-23(29)25(18,20)30)13-17-10-6-5-7-11-17/h5-8,10-12,14-15,18-22,28,30H,9,13H2,1-4H3,(H,26,29)/b12-8+/t14-,15-,18-,19-,20-,21+,22-,24+,25+/m0/s1
InChIKeyKMJNSPVEHHWLFP-BVBVFGOZSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1016/j.phytol.2016.06.006)
ChEBI Ontology
Outgoing Relation(s)
Cytochalasin Z15E (CHEBI:219871) is a isoindoles (CHEBI:24897)
IUPAC Name 
(1aS,2S,2aS,5S,5aS,6S,6aR)-5-benzyl-2a-hydroxy-2-[(E,4S,5R)-5-hydroxy-4-methyl-6-oxohept-1-enyl]-6,6a-dimethyl-1a,2,4,5,5a,6-hexahydrooxireno[2,3-]isoindol-3-one
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78443514ChemSpider