CHEBI:193558 - yaequinolone D

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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 yaequinolone D
ChEBI ID CHEBI:193558
Definition Published in DOI:10.1038/ja.2006.86
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C27H33NO7
Net Charge 0
Average Mass 483.561
Monoisotopic Mass 483.22570
InChI InChI=1S/C27H33NO7/c1-25(2)14-15-26(3,35-24(25)31)13-12-16-6-11-19-20(21(16)29)27(32,22(34-5)23(30)28-19)17-7-9-18(33-4)10-8-17/h6-13,22,24,29,31-32H,14-15H2,1-5H3,(H,28,30)/b13-12+/t22-,24?,26?,27+/m0/s1
InChIKey XEODWAJPLQOYPN-XARLSHHXSA-N
SMILES O[C@]1([C@@H](OC)C(=O)NC2=C1C(O)=C(C=C2)/C=C/C3(CCC(C(O3)O)(C)C)C)C4=CC=C(OC)C=C4
ChEBI Ontology
Outgoing yaequinolone D (CHEBI:193558) is a quinolone (CHEBI:23765)
Synonym Source
yaequinolone D UniProt