Sialosonic acid (CHEBI:176465)

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CHEBI:176465 - Sialosonic acid

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ChEBI ID	CHEBI:176465
ChEBI Name	Sialosonic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C9H16O9
Net Charge	0
Average Mass	268.218
Monoisotopic Mass	268.07943
SMILES	O=C(O)C(=O)C[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
WURCS	WURCS=2.0/1,1,0/[AOd21122h]/1/
InChI	InChI=1S/C9H16O9/c10-2-5(13)7(15)8(16)6(14)3(11)1-4(12)9(17)18/h3,5-8,10-11,13-16H,1-2H2,(H,17,18)/t3-,5+,6+,7+,8+/m0/s1
InChIKey	FQHUAUMYHAJTDH-GRCPKETISA-N

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)	urine (BTO:0001419)	MetaboLights (MTBLS2295)

ChEBI Ontology

Outgoing Relation(s)
	Sialosonic acid (CHEBI:176465) is a L-α-D-Hepp-(1→7)-L-α-D-Hepp-(1→3)-L-α-D-Hepp-(1→5)-α-Kdo (CHEBI:78618)

IUPAC Name
(4S,5R,6R,7R,8R)-4,5,6,7,8,9-hexahydroxy-2-oxononanoic acid

Manual Xrefs	Databases
110265	ChemSpider

Registry Numbers	Sources
CAS:22594-61-2	ChemIDplus