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CHEBI:213587 - Colletotryptin B

ChEBI IDCHEBI:213587
ChEBI NameColletotryptin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22N2O3
Net Charge0
Average Mass350.418
Monoisotopic Mass350.16304
SMILESOCCc1c([C@H](c2cnc3ccccc23)[C@H](O)CO)nc2ccccc12
InChIInChI=1S/C21H22N2O3/c24-10-9-15-13-5-2-4-8-18(13)23-21(15)20(19(26)12-25)16-11-22-17-7-3-1-6-14(16)17/h1-8,11,19-20,22-26H,9-10,12H2/t19-,20-/m1/s1
InChIKeyGTKKLIYNQCXJMH-WOJBJXKFSA-N
Species of MetaboliteComponentSourceComments
Colletotrichum (ncbitaxon:5455) - PubMed (31870947)
ChEBI Ontology
Outgoing Relation(s)
Colletotryptin B (CHEBI:213587) is a indoles (CHEBI:24828)
IUPAC Name 
(2S,3S)-3-[3-(2-hydroxyethyl)-1H-indol-2-yl]-3-(1H-indol-3-yl)propane-1,2-diol