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(Z)-desulfoglucotropeolin

Properties

Image

Occurences in reactions

MNX_ID

MNXM2115

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	3

formula

C₁₄H₁₉NO₆S

charge

mass

329.09331

reference

InChIKey

QXWFHEDNDCNERW-RFEZBLSLSA-N

InChI

InChI=1S/C14H19NO6S/c16-7-9-11(17)12(18)13(19)14(21-9)22-10(15-20)6-8-4-2-1-3-5-8/h1-5,9,11-14,16-20H,6-7H2/b15-10-/t9-,11-,12+,13-,14+/m1/s1

SMILES

OC[C@H]1O[C@@H](S/C(Cc2ccccc2)=N\O)[C@H](O)[C@@H](O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:136422 chebi:136422	(Z)-desulfoglucotropeolin 1-S-[(1Z)-N-hydroxy-2-phenylethanimidoyl]-1-thio-beta-D-glucopyranose
sabiork.compound:5381 sabiorkM:5381 kegg.compound:C01069 keggC:C01069	Desulfoglucotropeolin
seed.compound:cpd00787 seedM:cpd00787	Desulfoglucotropeolin benzyl-desulfoglucosinolate desulfoglucotropaeolin desulfoglucotropeolin
metacyc.compound:BENZYL-DESULFOGLUCOSINOLATE metacycM:BENZYL-DESULFOGLUCOSINOLATE	desulfoglucotropaeolin
seed.compound:cpd29200 seedM:cpd29200	desulfoglucotropeolin
CHEBI:15911 chebi:15911	desulfoglucotropeolin 1-S-(N-hydroxy-2-phenylethanimidoyl)-1-thio-beta-D-glucopyranose Desulfoglucotropeolin
chebi:14131 chebi:23647 chebi:4455 keggC:M_C01069 seedM:M_cpd00787 seedM:M_cpd29200	secondary/obsolete/fantasy identifier