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CHEBI:223756 - 22-Oxa-(12)-cytochalasa-6(12),13,19-triene-1,21-dione-7,18-dihydroxy-16,18-dimethyl-10-phenyl-(7S*,13E,16S*,18S*,19E)

ChEBI IDCHEBI:223756
ChEBI Name22-Oxa-(12)-cytochalasa-6(12),13,19-triene-1,21-dione-7,18-dihydroxy-16,18-dimethyl-10-phenyl-(7S*,13E,16S*,18S*,19E)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H35NO5
Net Charge0
Average Mass465.590
Monoisotopic Mass465.25152
SMILESC=C1[C@H](C)[C@@H]2[C@@H](Cc3ccccc3)NC(=O)[C@@]23OC(=O)/C=C/[C@](C)(O)C[C@H](C)C/C=C/[C@@H]3[C@H]1O
InChIInChI=1S/C28H35NO5/c1-17-9-8-12-21-25(31)19(3)18(2)24-22(15-20-10-6-5-7-11-20)29-26(32)28(21,24)34-23(30)13-14-27(4,33)16-17/h5-8,10-14,17-18,21-22,24-25,31,33H,3,9,15-16H2,1-2,4H3,(H,29,32)/b12-8+,14-13+/t17-,18+,21-,22-,24-,25+,27+,28+/m1/s1
InChIKeyLDMZOJRULITYER-UYTFYGOYSA-N
Species of MetaboliteComponentSourceComments
Daldiniaspecies (ncbitaxon:1769485) - DOI (10.1016/0031-9422(95)00644-3)
ChEBI Ontology
Outgoing Relation(s)
22-Oxa-(12)-cytochalasa-6(12),13,19-triene-1,21-dione-7,18-dihydroxy-16,18-dimethyl-10-phenyl-(7S*,13E,16S*,18S*,19E) (CHEBI:223756) is a isoindoles (CHEBI:24897)
IUPAC Name 
(1R,4E,6R,8R,10E,12R,13R,15R,16R,17R)-17-benzyl-6,13-dihydroxy-6,8,15-trimethyl-14-methylidene-2-oxa-18-azatricyclo[10.7.0.01,16]nonadeca-4,10-diene-3,19-dione
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78438268ChemSpider