CHEBI:198844 - Amycocyclopiazonic acid

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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 Amycocyclopiazonic acid
ChEBI ID CHEBI:198844
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H20N2O2
Net Charge 0
Average Mass 296.370
Monoisotopic Mass 296.15248
InChI InChI=1S/C18H20N2O2/c1-18(2)11-6-9-4-3-5-12-15(9)10(8-19-12)16(11)17-13(21)7-14(22)20(17)18/h3-5,8,11,13,16-17,19,21H,6-7H2,1-2H3/t11-,13-,16+,17+/m1/s1
InChIKey SMXNLCYMHFJNLF-AQMVCYDESA-N
SMILES O=C1N2C([C@@H]3CC=4C=CC=C5C4C([C@@H]3[C@@H]2[C@@H](C1)O)=CN5)(C)C
Metabolite of Species Details
Amycolatopsisspecies (NCBI:txid37632) See: PubMed
ChEBI Ontology
Outgoing Amycocyclopiazonic acid (CHEBI:198844) is a indoles (CHEBI:24828)
IUPAC Name
(2R,3R,4R,9R)-4-hydroxy-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.02,9.03,7.015,18]octadeca-1(17),11(18),12,14-tetraen-6-one
Manual Xref Database
32675025 ChemSpider
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