| Name |
5-Hydroxyglucobrassicin
5-Hydroxy-3-indolylmethylglucosinolate |
| Formula |
C16H20N2O10S2 |
| Mw |
464.05593634 |
| CAS RN |
87592-99-2 |
| C_ID |
C00000130
, 
|
| InChIKey |
SNGNIBNFTIUEHD-BDBHUYAFNA-N |
| InChICode |
InChI=1S/C16H20N2O10S2/c19-6-11-13(21)14(22)15(23)16(27-11)29-12(18-28-30(24,25)26)3-7-5-17-10-2-1-8(20)4-9(7)10/h1-2,4-5,11,13-17,19-23H,3,6H2,(H,24,25,26)/b18-12-/t11-,13-,14+,15-,16+/m1/s1 |
| SMILES |
c1(ccc2c(c1)c(c[nH]2)C/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 |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cruciferae | Brassica oleracea var. botrytis  | Ref. |
| Plantae | Cruciferae | Brassica oleracea var. gongylodes | Ref. |
| Plantae | Cruciferae | Isatis tinctoria Linn | Ref. |
|
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