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CHEBI:216092 - Armochaetoglasin G

ChEBI IDCHEBI:216092
ChEBI NameArmochaetoglasin G
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SubmitterMetaboLights
DownloadsMolfile
FormulaC33H40N2O5
Net Charge0
Average Mass544.692
Monoisotopic Mass544.29372
SMILESCO[C@@H](c1cnc2ccccc12)[C@@H]1NC(=O)[C@@]23C(=O)CC[C@H](O)C(=O)/C(C)=C/[C@@H](C)C/C=C/[C@H]2C=C(C)[C@@H](C)[C@@H]13
InChIInChI=1S/C33H40N2O5/c1-18-9-8-10-22-16-19(2)21(4)28-29(31(40-5)24-17-34-25-12-7-6-11-23(24)25)35-32(39)33(22,28)27(37)14-13-26(36)30(38)20(3)15-18/h6-8,10-12,15-18,21-22,26,28-29,31,34,36H,9,13-14H2,1-5H3,(H,35,39)/b10-8+,20-15+/t18-,21+,22-,26-,28-,29+,31-,33+/m0/s1
InChIKeyJGTOXGPLZVQLAM-JYSUZCBZSA-N
Species of MetaboliteComponentSourceComments
Chaetomium (ncbitaxon:5149) - PubMed (30268043)
ChEBI Ontology
Outgoing Relation(s)
Armochaetoglasin G (CHEBI:216092) is a indoles (CHEBI:24828)
IUPAC Name 
(1S,5S,7E,9S,11E,13S,16S,17R,18R)-5-hydroxy-18-[(S)-1H-indol-3-yl(methoxy)methyl]-7,9,15,16-tetramethyl-19-azatricyclo[11.7.0.01,17]icosa-7,11,14-triene-2,6,20-trione
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78442217ChemSpider