TRIBOA beta-D-glucoside (CHEBI:63671)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:63671 - TRIBOA β-D-glucoside

Default Structure

Take structure to advanced search

ChEBI ID	CHEBI:63671
ChEBI Name	TRIBOA β-D-glucoside
Stars
ASCII Name	TRIBOA beta-D-glucoside
Definition	A β-D-glucoside having (R)-2,4,7-trihydroxy-2H-1,4-benzoxazin-3(4H)-one as the anomeric substituent.
Last Modified	29 January 2014
Submitter	Kristian Axelsen
Downloads	Molfile

Formula	C14H17NO10
Net Charge	0
Average Mass	359.287
Monoisotopic Mass	359.08525
SMILES	O=C1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Oc2cc(O)ccc2N1O
InChI	InChI=1S/C14H17NO10/c16-4-8-9(18)10(19)11(20)13(24-8)25-14-12(21)15(22)6-2-1-5(17)3-7(6)23-14/h1-3,8-11,13-14,16-20,22H,4H2/t8-,9-,10+,11-,13+,14-/m1/s1
InChIKey	YCPMEKOJGFYFJJ-TWTZXXGESA-N

ChEBI Ontology

Outgoing Relation(s)
	TRIBOA β-D-glucoside (CHEBI:63671) has functional parent TRIBOA (CHEBI:63746)
	TRIBOA β-D-glucoside (CHEBI:63671) is a benzoxazine (CHEBI:46969)
	TRIBOA β-D-glucoside (CHEBI:63671) is a cyclic hydroxamic acid (CHEBI:23445)
	TRIBOA β-D-glucoside (CHEBI:63671) is a β-D-glucoside (CHEBI:22798)

IUPAC Name
(2R)-4,7-dihydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl β-D-glucopyranoside

Synonym	Source
(R)-TRIBOA β-D-glucoside	ChEBI

UniProt Name	Source
TRIBOA β-D-glucoside	UniProt

Citations