(2R,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[(2R,3R,4R,5R)-6-hydroxy-2-(hydroxymethyl)-5-(sulfoamino)-4-sulfooxyoxan-3-yl]oxyoxane-2-carboxylic acid (CHEBI:152805)

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CHEBI:152805 - (2R,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[(2R,3R,4R,5R)-6-hydroxy-2-(hydroxymethyl)-5-(sulfoamino)-4-sulfooxyoxan-3-yl]oxyoxane-2-carboxylic acid

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ChEBI ID	CHEBI:152805
ChEBI Name	(2R,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[(2R,3R,4R,5R)-6-hydroxy-2-(hydroxymethyl)-5-(sulfoamino)-4-sulfooxyoxan-3-yl]oxyoxane-2-carboxylic acid
Stars
Submitter	Gareth Owen
Downloads	Molfile

Formula	C12H21NO17S2
Net Charge	0
Average Mass	515.424
Monoisotopic Mass	515.02509
SMILES	O=C(O)[C@@H]1O[C@@H](O[C@H]2[C@H](OS(=O)(=O)O)[C@@H](NS(=O)(=O)O)C(O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
WURCS	WURCS=2.0/2,2,1/[a2122h-1x_1-5_2NSO/3=O/3=O_3OSO/3=O/3=O][a2121A-1a_1-5]/1-2/a4-b1
InChI	InChI=1S/C12H21NO17S2/c14-1-2-7(28-12-6(17)4(15)5(16)9(29-12)10(18)19)8(30-32(24,25)26)3(11(20)27-2)13-31(21,22)23/h2-9,11-17,20H,1H2,(H,18,19)(H,21,22,23)(H,24,25,26)/t2-,3-,4+,5+,6-,7-,8-,9-,11?,12-/m1/s1
InChIKey	WLFJZMYYKJMMJM-VYYGVVRNSA-N

ChEBI Ontology

Outgoing Relation(s)
	(2R,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[(2R,3R,4R,5R)-6-hydroxy-2-(hydroxymethyl)-5-(sulfoamino)-4-sulfooxyoxan-3-yl]oxyoxane-2-carboxylic acid (CHEBI:152805) is a glucosiduronic acid (CHEBI:24302)

Synonyms	Source
alpha-L-ido-hexopyranosyluronic acid-(1->4)-2-deoxy-3-O-sulfo-2-sulfoamino-D-gluco-hexopyranose	SUBMITTER
IdoA(a1-4)GlcNS3S	SUBMITTER

Manual Xrefs	Databases
G64152OT	GlyTouCan
G64152OT	GlyGen