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CHEBI:217613 - (-)-6-epi-notoamide I

ChEBI IDCHEBI:217613
ChEBI Name(-)-6-epi-notoamide I
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H27N3O4
Net Charge0
Average Mass445.519
Monoisotopic Mass445.20016
SMILESCC1(C)C=Cc2c(ccc3c4c(nc23)C(C)(C)[C@@H]2C[C@@]35CCCN3C(=O)[C@@]2(NC5=O)C4=O)O1
InChIInChI=1S/C26H27N3O4/c1-23(2)10-8-13-15(33-23)7-6-14-17-19(27-18(13)14)24(3,4)16-12-25-9-5-11-29(25)22(32)26(16,20(17)30)28-21(25)31/h6-8,10,16,27H,5,9,11-12H2,1-4H3,(H,28,31)/t16-,25+,26-/m0/s1
InChIKeyCDJZXTFDGOKTOT-HKFLSJHISA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (29622844)
ChEBI Ontology
Outgoing Relation(s)
(-)-6-epi-notoamide I (CHEBI:217613) is a pyrroloquinoline (CHEBI:50918)
IUPAC Name 
(1S,17S,19R)-9,9,16,16-tetramethyl-8-oxa-14,23,25-triazaheptacyclo[17.5.2.01,17.03,15.04,13.07,12.019,23]hexacosa-3(15),4(13),5,7(12),10-pentaene-2,24,26-trione