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CHEBI:218629 - 10-Phenyl-[11]-cytochalasan E

ChEBI IDCHEBI:218629
ChEBI Name10-Phenyl-[11]-cytochalasan E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H39NO6
Net Charge0
Average Mass509.643
Monoisotopic Mass509.27774
SMILESC=C1[C@@H](C)[C@H]2[C@H](Cc3ccccc3)NC(=O)[C@@]23C(=O)C[C@@H](OC(C)=O)[C@@](C)(O)C[C@@H](C)C/C=C\[C@H]3[C@@H]1O
InChIInChI=1S/C30H39NO6/c1-17-10-9-13-22-27(34)19(3)18(2)26-23(14-21-11-7-6-8-12-21)31-28(35)30(22,26)24(33)15-25(37-20(4)32)29(5,36)16-17/h6-9,11-13,17-18,22-23,25-27,34,36H,3,10,14-16H2,1-2,4-5H3,(H,31,35)/b13-9-/t17-,18+,22-,23-,25+,26-,27+,29-,30-/m0/s1
InChIKeyYQTLQXJVBUFVDY-RXUIYFKQSA-N
Species of MetaboliteComponentSourceComments
Daldiniaspecies (ncbitaxon:1769485) - DOI (10.1016/0031-9422(95)00201-h)
ChEBI Ontology
Outgoing Relation(s)
10-Phenyl-[11]-cytochalasan E (CHEBI:218629) is a isoindoles (CHEBI:24897)
IUPAC Name 
[(1S,4R,5S,7S,9Z,11R,12S,14S,15R,16S)-16-benzyl-5,12-dihydroxy-5,7,14-trimethyl-13-methylidene-2,18-dioxo-17-azatricyclo[9.7.0.01,15]octadec-9-en-4-yl] acetate
Manual XrefsDatabases
78437605ChemSpider