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CHEBI:211728 - (11)-Cytochalasa-5,13,19-triene-l,21-dione-7-hydroperoxy-17-hydroxy-16,18-dimethyl-10-phenyl-(5Z*,7S*,13E,16S*,17R*,18S*,19E)

ChEBI IDCHEBI:211728
ChEBI Name(11)-Cytochalasa-5,13,19-triene-l,21-dione-7-hydroperoxy-17-hydroxy-16,18-dimethyl-10-phenyl-(5Z*,7S*,13E,16S*,17R*,18S*,19E)
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SubmitterMetaboLights
DownloadsMolfile
FormulaC28H35NO5
Net Charge0
Average Mass465.590
Monoisotopic Mass465.25152
SMILESCC1=C(C)[C@H](OO)[C@H]2/C=C/C[C@@H](C)[C@H](O)[C@H](C)/C=C/C(=O)[C@@]23C(=O)N[C@H](Cc2ccccc2)[C@@H]13
InChIInChI=1S/C28H35NO5/c1-16-9-8-12-21-26(34-33)19(4)18(3)24-22(15-20-10-6-5-7-11-20)29-27(32)28(21,24)23(30)14-13-17(2)25(16)31/h5-8,10-14,16-17,21-22,24-26,31,33H,9,15H2,1-4H3,(H,29,32)/b12-8+,14-13+/t16-,17-,21-,22-,24-,25+,26+,28+/m1/s1
InChIKeyYZMKUCUMIIGSIT-BPPJWCPBSA-N
Species of MetaboliteComponentSourceComments
Daldiniaspecies (ncbitaxon:1769485) - DOI (10.1016/0031-9422(95)00644-3)
ChEBI Ontology
Outgoing Relation(s)
(11)-Cytochalasa-5,13,19-triene-l,21-dione-7-hydroperoxy-17-hydroxy-16,18-dimethyl-10-phenyl-(5Z*,7S*,13E,16S*,17R*,18S*,19E) (CHEBI:211728) is a isoindoles (CHEBI:24897)
IUPAC Name 
(1S,3E,5R,6S,7R,9E,11S,12R,15S,16R)-16-benzyl-12-hydroperoxy-6-hydroxy-5,7,13,14-tetramethyl-17-azatricyclo[9.7.0.01,15]octadeca-3,9,13-triene-2,18-dione
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