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CHEBI:211266 - Deacetyl-5,6-dihydro-7-oxo-19,20-epoxycytochalasin C

ChEBI IDCHEBI:211266
ChEBI NameDeacetyl-5,6-dihydro-7-oxo-19,20-epoxycytochalasin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H35NO6
Net Charge0
Average Mass481.589
Monoisotopic Mass481.24644
SMILESC[C@H]1[C@H]2[C@H](Cc3ccccc3)NC(=O)[C@]23[C@H](O)[C@@H]2O[C@@H]2[C@@](C)(O)C(=O)[C@@H](C)C/C=C/[C@H]3C(=O)[C@@H]1C
InChIInChI=1S/C28H35NO6/c1-14-9-8-12-18-21(30)16(3)15(2)20-19(13-17-10-6-5-7-11-17)29-26(33)28(18,20)24(32)22-25(35-22)27(4,34)23(14)31/h5-8,10-12,14-16,18-20,22,24-25,32,34H,9,13H2,1-4H3,(H,29,33)/b12-8+/t14-,15+,16+,18-,19-,20-,22-,24+,25-,27-,28-/m0/s1
InChIKeyOWYWTMZOLYVRDL-PQNBHECFSA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - PubMed (31271786)
ChEBI Ontology
Outgoing Relation(s)
Deacetyl-5,6-dihydro-7-oxo-19,20-epoxycytochalasin C (CHEBI:211266) is a isoindoles (CHEBI:24897)
IUPAC Name 
(1R,2S,3S,5S,6R,8S,10E,12R,14R,15S,16R,17S)-17-benzyl-2,6-dihydroxy-6,8,14,15-tetramethyl-4-oxa-18-azatetracyclo[10.7.0.01,16.03,5]nonadec-10-ene-7,13,19-trione