CHEBI:202388 - A-500359 F

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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 A-500359 F
ChEBI ID CHEBI:202388
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H21N3O12
Net Charge 0
Average Mass 459.364
Monoisotopic Mass 459.11252
InChI InChI=1S/C17H21N3O12/c1-29-10-9(24)14(20-3-2-7(22)19-17(20)28)31-11(10)12(13(18)25)32-16-8(23)5(21)4-6(30-16)15(26)27/h2-5,8-12,14,16,21,23-24H,1H3,(H2,18,25)(H,26,27)(H,19,22,28)/t5-,8+,9-,10+,11?,12+,14-,16+/m1/s1
InChIKey HSYSEXUSWSMTOS-WDFUBWJHSA-N
SMILES O=C1N(C=CC(N1)=O)[C@@H]2OC([C@H](O[C@@H]3OC(C(=O)O)=C[C@H]([C@@H]3O)O)C(=O)N)[C@H]([C@H]2O)OC
Metabolite of Species Details
Streptomyces griseus (NCBI:txid1911) See: PubMed
ChEBI Ontology
Outgoing A-500359 F (CHEBI:202388) is a N-glycosyl compound (CHEBI:21731)
IUPAC Name
(2R,3S,4R)-2-[(1S)-2-amino-1-[(3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-3-methoxyoxolan-2-yl]-2-oxoethoxy]-3,4-dihydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid
Manual Xref Database
78436863 ChemSpider
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