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4-methoxyglucobrassicin

MNXM10215 is deprecated and here replaced by MNXM1104977
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM1104977Image of MNXM1104977
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC17H22N2O10S2
charge0
mass478.07159
referencechebi:1890
InChIKeyIIAGSABLXRZUSE-UFRBAHOGSA-N
InChIInChI=1S/C17H22N2O10S2/c1-27-10-4-2-3-9-13(10)8(6-18-9)5-12(19-29-31(24,25)26)30-17-16(23)15(22)14(21)11(7-20)28-17/h2-4,6,11,14-18,20-23H,5,7H2,1H3,(H,24,25,26)/t11-,14-,15+,16-,17+/m1/s1
SMILESCOc1cccc2[nH]cc(CC(=NOS(=O)(=O)O)S[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c12
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:1890
chebi:1890 		4-methoxyglucobrassicin
1-S-[2-(4-methoxy-1H-indol-3-yl)-N-(sulfooxy)ethanimidoyl]-1-thio-beta-D-glucopyranose
4-Methoxy-3-indolylmethyl glucosinolate
4-Methoxyglucobrassicin
4-Moimg
4-methoxy-3-indolylmethylglucosinolate
4-methoxyindol-3-ylmethylglucosinolate
kegg.compound:C08423
keggC:C08423 		4-Methoxyglucobrassicin
4-Methoxy-3-indolylmethyl glucosinolate
CHEBI:62725
chebi:62725 		4-methoxyglucobrassicin(1-)
1-S-[2-(4-methoxy-1H-indol-3-yl)-N-(sulfonatooxy)ethanimidoyl]-1-thio-beta-D-glucopyranose
4-methoxyglucobrassicin anion
keggC:M_C08423 secondary/obsolete/fantasy identifier