(2R,3R,4R,5S)-6-[1-(3-carbamoyl-4,5-dihydroxyphenyl)-2-[(4-phenylbutan-2-yl)amino]ethoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CHEBI:143444)

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CHEBI:143444 - (2R,3R,4R,5S)-6-[1-(3-carbamoyl-4,5-dihydroxyphenyl)-2-[(4-phenylbutan-2-yl)amino]ethoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

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ChEBI ID	CHEBI:143444
ChEBI Name	(2R,3R,4R,5S)-6-[1-(3-carbamoyl-4,5-dihydroxyphenyl)-2-[(4-phenylbutan-2-yl)amino]ethoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
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Submitter	mwilliams
Downloads	Molfile

Formula	C25H32N2O10
Net Charge	0
Average Mass	520.535
Monoisotopic Mass	520.20570
SMILES	CC(CCc1ccccc1)NCC(OC1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)c1cc(O)c(O)c(C(N)=O)c1
InChI	InChI=1S/C25H32N2O10/c1-12(7-8-13-5-3-2-4-6-13)27-11-17(14-9-15(23(26)33)18(29)16(28)10-14)36-25-21(32)19(30)20(31)22(37-25)24(34)35/h2-6,9-10,12,17,19-22,25,27-32H,7-8,11H2,1H3,(H2,26,33)(H,34,35)/t12?,17?,19-,20-,21+,22-,25?/m0/s1
InChIKey	LQOOOSFQSVHCBK-ZOYKYWDOSA-N

ChEBI Ontology

Outgoing Relation(s)
	(2R,3R,4R,5S)-6-[1-(3-carbamoyl-4,5-dihydroxyphenyl)-2-[(4-phenylbutan-2-yl)amino]ethoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CHEBI:143444) is a glucosiduronic acid (CHEBI:24302)