| more general categories | information about this item |  | 
| | 01. Food Nutrient & Dietary Chemicals |  |  |  |
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 | 01. Food Nutrient & Dietary Chemicals |  | 
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|  | 4-methoxyglucobrassicin [CHEBI:1890] (1) |  | 
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| | 03. Biological Effects of Specific Chemicals |  |  |  |
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 | 03. Biological Effects of Specific Chemicals |  | 
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|  | 4-methoxyglucobrassicin [CHEBI:1890] (1) |  | 
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| | 08. Chemical Category |  |  |  |
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 | 08. Chemical Category |  | 
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|  | 4-methoxyglucobrassicin [CHEBI:1890] (1) |  | 
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|  | 4-methoxyglucobrassicin [CHEBI:1890] (1) |  | 
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|  | 4-methoxyglucobrassicin [CHEBI:1890] (1) |  | 
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|  | 4-methoxyglucobrassicin [CHEBI:1890] (1) |  | 
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|  | 4-methoxyglucobrassicin [CHEBI:1890] (1) |  | 
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|  | 4-methoxyglucobrassicin [CHEBI:1890] (1) |  | 
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|  | 4-methoxyglucobrassicin [CHEBI:1890] (1) |  | 
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|  | 4-methoxyglucobrassicin [CHEBI:1890] (1) |  | 
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| ChEBI Compound Accession Identifier: | [CHEBI:1890] | 
| ChEBI Compound Description: | An indolylmethylglucosinolate that is glucobrassicin bearing a methoxy substituent at position 4 on the indole ring. | 
| ChEBI Compound Identification Number: | 1890 | 
| ChEBI InChI Value: | InChI=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 | 
| ChEBI InChIKey Value: | IIAGSABLXRZUSE-UFRBAHOGSA-N | 
| ChEBI Compound Name: | 4-methoxyglucobrassicin | 
| ChEBI SMILES Value: | COc1cccc2[nH]cc(CC(S[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=NOS(O)(=O)=O)c12 | 
| ChEBI Substance ID: | 14717875 | 
| ChEBI URL: | ChEBI:1890 | 
| ChemSpider ID: | 7851179 | 
| Ontomatica Chemical Accession Key (OnChAKey): | IIAGSABLXRZUSE_UFRBAHOGSA_N_000_000000 | 
| PubChem Compound ID: | 9576738 |