CHEBI:210982 - Pyranamide A

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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 Pyranamide A
ChEBI ID CHEBI:210982
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H27N3O5
Net Charge 0
Average Mass 425.485
Monoisotopic Mass 425.19507
InChI InChI=1S/C23H27N3O5/c1-4-14(2)18-19-25-21(28)23(12-8-11-17(30-3)31-23)22(29)26(19)16(20(27)24-18)13-15-9-6-5-7-10-15/h5-11,14,16-17H,4,12-13H2,1-3H3,(H,24,27)(H,25,28)/t14-,16+,17-,23+/m0/s1
InChIKey QUZPSHSECUXMNA-PCQCASEHSA-N
SMILES O=C1N2C(NC([C@@]13O[C@H](OC)C=CC3)=O)=C(NC([C@H]2CC4=CC=CC=C4)=O)[C@H](CC)C
Metabolite of Species Details
Aspergillus (NCBI:txid5052) See: DOI
ChEBI Ontology
Outgoing Pyranamide A (CHEBI:210982) is a pyrimidone (CHEBI:38337)
IUPAC Name
(2S,6R,6'R)-6'-benzyl-9'-[(2S)-butan-2-yl]-2-methoxyspiro[2,5-dihydropyran-6,3'-6,8-dihydro-1H-pyrazino[1,2-a]pyrimidine]-2',4',7'-trione
Manual Xref Database
71360606 ChemSpider
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