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CHEBI:202616 - Trichalasin E

ChEBI IDCHEBI:202616
ChEBI NameTrichalasin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H35NO7
Net Charge0
Average Mass449.544
Monoisotopic Mass449.24135
SMILESCC1=C[C@H]2[C@H](OO)C(C)=C(C)[C@H]3[C@H](CC(C)C)NC(=O)[C@@]23OC(=O)C=C[C@H](O)[C@H](O)CC1
InChIInChI=1S/C24H35NO7/c1-12(2)10-17-21-14(4)15(5)22(32-30)16-11-13(3)6-7-18(26)19(27)8-9-20(28)31-24(16,21)23(29)25-17/h8-9,11-12,16-19,21-22,26-27,30H,6-7,10H2,1-5H3,(H,25,29)/t16-,17-,18+,19-,21-,22+,24+/m0/s1
InChIKeyTWCFECMVQLODGL-GJMRXRKDSA-N
Species of MetaboliteComponentSourceComments
Trichoderma gamsii (ncbitaxon:398673) - PubMed (24752139)
ChEBI Ontology
Outgoing Relation(s)
Trichalasin E (CHEBI:202616) is a isoindoles (CHEBI:24897)
IUPAC Name 
(1S,6S,7R,12S,13S,16S,17S)-13-hydroperoxy-6,7-dihydroxy-10,14,15-trimethyl-17-(2-methylpropyl)-2-oxa-18-azatricyclo[10.7.0.01,16]nonadeca-4,10,14-triene-3,19-dione