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CHEBI:197724 - Cytochalasin Z19

ChEBI IDCHEBI:197724
ChEBI NameCytochalasin Z19
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H37NO8
Net Charge0
Average Mass527.614
Monoisotopic Mass527.25192
SMILESC=C1[C@@H](C)[C@H]2[C@H](Cc3ccccc3)NC(=O)[C@@]2(OC(=O)OC)[C@@H](/C=C/C[C@H](C)C(=O)C(C)(O)CC=O)[C@@H]1O
InChIInChI=1S/C29H37NO8/c1-17(25(33)28(4,36)14-15-31)10-9-13-21-24(32)19(3)18(2)23-22(16-20-11-7-6-8-12-20)30-26(34)29(21,23)38-27(35)37-5/h6-9,11-13,15,17-18,21-24,32,36H,3,10,14,16H2,1-2,4-5H3,(H,30,34)/b13-9+/t17-,18+,21-,22-,23-,24+,28?,29+/m0/s1
InChIKeyBRQWOHZQMWWOCO-UKDBMQGKSA-N
Species of MetaboliteComponentSourceComments
Aspergillus flavipes (ncbitaxon:41900) - DOI (10.1002/hlca.200800455)
ChEBI Ontology
Outgoing Relation(s)
Cytochalasin Z19 (CHEBI:197724) is a isoindoles (CHEBI:24897)
IUPAC Name 
[(1S,3aS,4S,5S,7S,7aS)-1-benzyl-5-hydroxy-4-[(E,4S)-6-hydroxy-4,6-dimethyl-5,8-dioxooct-1-enyl]-7-methyl-6-methylidene-3-oxo-1,2,4,5,7,7a-hexahydroisoindol-3a-yl] methyl carbonate
Manual XrefsDatabases
27024304ChemSpider