CHEBI:211178 - Notoamide X

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Notoamide X
ChEBI ID CHEBI:211178
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H27N3O5
Net Charge 0
Average Mass 461.518
Monoisotopic Mass 461.19507
InChI InChI=1S/C26H27N3O5/c1-23(2)10-8-13-15(34-23)7-6-14-17-19(29(33)18(13)14)24(3,4)16-12-25-9-5-11-28(25)22(32)26(16,20(17)30)27-21(25)31/h6-8,10,16,33H,5,9,11-12H2,1-4H3,(H,27,31)/t16-,25-,26+/m0/s1
InChIKey WUZAONONDREMBU-MEMLUFBQSA-N
SMILES O=C1N2[C@@]3(C(=O)N[C@]14C(=O)C=5C6=C(C7=C(OC(C)(C)C=C7)C=C6)N(C5C([C@@H]4C3)(C)C)O)CCC2
Metabolite of Species Details
Aspergillus ochraceus (NCBI:txid40380) See: DOI
ChEBI Ontology
Outgoing Notoamide X (CHEBI:211178) is a pyrroloquinoline (CHEBI:50918)
IUPAC Name
(1R,17S,19S)-14-hydroxy-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
Manual Xref Database
78315802 ChemSpider
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