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CHEBI:201918 - 19,20-epoxy-cytochalasin C

ChEBI IDCHEBI:201918
ChEBI Name19,20-epoxy-cytochalasin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H37NO7
Net Charge0
Average Mass523.626
Monoisotopic Mass523.25700
SMILESCC(=O)O[C@@H]1[C@@H]2O[C@H]2[C@@](C)(O)C(=O)[C@@H](C)C/C=C/[C@H]2[C@H](O)C(C)=C(C)[C@@H]3[C@H](Cc4ccccc4)NC(=O)[C@]132
InChIInChI=1S/C30H37NO7/c1-15-10-9-13-20-23(33)17(3)16(2)22-21(14-19-11-7-6-8-12-19)31-28(35)30(20,22)27(37-18(4)32)24-26(38-24)29(5,36)25(15)34/h6-9,11-13,15,20-24,26-27,33,36H,10,14H2,1-5H3,(H,31,35)/b13-9+/t15-,20-,21-,22+,23+,24+,26+,27+,29-,30-/m0/s1
InChIKeyZOSGFLUFAVFHCM-NSEIXYQZSA-N
Species of MetaboliteComponentSourceComments
Xylaria obovata (ncbitaxon:498170) - DOI (10.1016/s0031-9422(96)00780-7)
ChEBI Ontology
Outgoing Relation(s)
19,20-epoxy-cytochalasin C (CHEBI:201918) is a isoindoles (CHEBI:24897)
IUPAC Name 
[(1R,2S,3S,5R,6R,8S,10E,12R,13S,16S,17S)-17-benzyl-6,13-dihydroxy-6,8,14,15-tetramethyl-7,19-dioxo-4-oxa-18-azatetracyclo[10.7.0.01,16.03,5]nonadeca-10,14-dien-2-yl] acetate
Manual XrefsDatabases
78436785ChemSpider