478-Da MAA (CHEBI:214734)

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CHEBI:214734 - 478-Da MAA

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ChEBI ID	CHEBI:214734
ChEBI Name	478-Da MAA
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C19H30N2O12
Net Charge	0
Average Mass	478.451
Monoisotopic Mass	478.17987
SMILES	COC1C(NC(C(=O)O)C(C)O)=CC(O)(COC2OCC(O)C(O)C2O)CC1=NCC(=O)O
InChI	InChI=1S/C19H30N2O12/c1-8(22)13(17(28)29)21-10-4-19(30,3-9(16(10)31-2)20-5-12(24)25)7-33-18-15(27)14(26)11(23)6-32-18/h4,8,11,13-16,18,21-23,26-27,30H,3,5-7H2,1-2H3,(H,24,25)(H,28,29)
InChIKey	UUYGQNWMNPMULJ-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Nostoc commune (ncbitaxon:1178)	-	PubMed (21813286)

ChEBI Ontology

Outgoing Relation(s)
	478-Da MAA (CHEBI:214734) is a glycoside (CHEBI:24400)

IUPAC Name
2-[[5-(carboxymethylimino)-3-hydroxy-6-methoxy-3-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]cyclohexen-1-yl]amino]-3-hydroxybutanoic acid