EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:206686 - Epoxycytochalasin Z17

ChEBI IDCHEBI:206686
ChEBI NameEpoxycytochalasin Z17
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H33NO6
Net Charge0
Average Mass479.573
Monoisotopic Mass479.23079
SMILESCC1=CCC(=O)O[C@@]23C(=O)N[C@@H](Cc4ccccc4)[C@@H]2[C@@]2(C)O[C@@]2(C)[C@@H](O)[C@@H]3C=CC[C@H](C)C1=O
InChIInChI=1S/C28H33NO6/c1-16-9-8-12-19-24(32)27(4)26(3,35-27)23-20(15-18-10-6-5-7-11-18)29-25(33)28(19,23)34-21(30)14-13-17(2)22(16)31/h5-8,10-13,16,19-20,23-24,32H,9,14-15H2,1-4H3,(H,29,33)/t16-,19-,20-,23+,24-,26+,27-,28+/m0/s1
InChIKeyRKAAAUXLURSKIV-IZGWTYEKSA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - PubMed (30875204)
ChEBI Ontology
Outgoing Relation(s)
Epoxycytochalasin Z17 (CHEBI:206686) is a lactam (CHEBI:24995)
Epoxycytochalasin Z17 (CHEBI:206686) is a macrolide (CHEBI:25106)
IUPAC Name 
(1R,8S,12S,13S,14S,16R,17R,18S)-18-benzyl-13-hydroxy-6,8,14,16-tetramethyl-2,15-dioxa-19-azatetracyclo[10.8.0.01,17.014,16]icosa-5,10-diene-3,7,20-trione