| Name |
4-hydroxyglucobrassicin
4-Hydroxyglucobrassicin
4-Hydroxy-3-indolylmethylglucosinolate |
| Formula |
C16H20N2O10S2 |
| Mw |
464.05593634 |
| CAS RN |
83327-20-2 |
| C_ID |
C00000127
, 
|
| InChIKey |
CSMYCLLHRFFFLG-HKSFWCCONA-N |
| InChICode |
InChI=1S/C16H20N2O10S2/c19-6-10-13(21)14(22)15(23)16(27-10)29-11(18-28-30(24,25)26)4-7-5-17-8-2-1-3-9(20)12(7)8/h1-3,5,10,13-17,19-23H,4,6H2,(H,24,25,26)/b18-11-/t10-,13-,14+,15-,16+/m1/s1 |
| SMILES |
c1cc(c2c(c1)[nH]cc2C/C(=N/OS(=O)(=O)O)/S[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Tyr Anthranilate |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Bataceae | Batis maritima | Ref. |
| Plantae | Capparaceae | Capparis spinosa  | Ref. |
| Plantae | Cruciferae | Brassica juncea | Ref. |
| Plantae | Cruciferae | Brassica napus | Ref. |
| Plantae | Cruciferae | Brassica napus var. napobrassica | Ref. |
| Plantae | Cruciferae | Brassica oleracea | Ref. |
| Plantae | Cruciferae | Brassica rapa | Ref. |
| Plantae | Cruciferae | Brassica sp | Ref. |
| Plantae | Cruciferae | Brassica sp. | Ref. |
| Plantae | Cruciferae | Brassica sprouts | Ref. |
| Plantae | Cruciferae | Conringia orientalis | Ref. |
| Plantae | Cruciferae | Diplotaxis erucoides | Ref. |
| Plantae | Cruciferae | Isatis djurdjura | Ref. |
| Plantae | Cruciferae | Isatis tinctoria | Ref. |
| Plantae | Cruciferae | Moricandia arvensis | Ref. |
| Plantae | Cruciferae | Raphanus sativus | Ref. |
| Plantae | Cruciferae | Schouwia purpurea | Ref. |
| Plantae | Tovariaceae | Tovaria pendula Ruiz.et Pav. | Ref. |
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