metabolite_name C18-RN1-neg C18-RN2-neg C18-RN3-neg C18-RN4-neg C18-RN5-neg C18-RN6-neg C18-RN7-neg C18-RN8-neg C18-RN9-neg C18-RN10-neg C18-RN11-neg C18-RN12-neg C18-RN13-neg C18-RN14-neg C18-RN15-neg C18-RN16-neg C18-RN17-neg C18-RN18-neg C18-RN19-neg C18-RN20-neg C18-RN21-neg C18-RN22-neg C18-RN23-neg C18-RN24-neg C18-RN25-neg C18-RN26-neg C18-RN27-neg C18-RN28-neg C18-RN29-neg C18-RN30-neg C18-RN31-neg C18-RN32-neg C18-RN33-neg C18-RN34-neg C18-RN35-neg C18-RN36-neg 4-Hydroxyglucobrassicin 0.013 0.036 0.088 0.062 0.034 0.023 0.327 0.161 0.176 0.293 0.101 0.311 0.084 0.096 0.030 0.030 0.036 0.019 1.158 0.815 1.126 0.227 0.679 1.139 0.335 0.096 0.161 0.427 0.171 0.362 1.013 0.191 1.220 0.445 0.515 1.199 Glucobrassicin 0.021 0.068 0.111 0.051 0.036 0.015 0.350 0.194 0.117 0.156 0.105 0.193 0.069 0.092 0.018 0.024 0.034 0.012 1.150 0.858 0.576 0.290 0.690 1.139 0.567 0.083 0.114 1.157 0.214 0.135 1.032 0.167 0.741 0.439 0.346 1.199 Gluconapin 0.008 0.036 0.055 0.020 0.010 0.004 0.174 0.174 0.126 0.172 0.121 0.246 0.025 0.031 0.008 0.007 0.000 0.003 0.394 0.438 0.602 0.230 0.674 0.818 0.783 0.021 0.051 1.087 0.049 0.058 0.824 0.093 1.129 0.369 0.200 1.199 Gluconasturtiin 0.002 0.014 0.034 0.012 0.008 0.002 0.131 0.040 0.031 0.032 0.019 0.043 0.021 0.024 0.005 0.010 0.011 0.004 0.667 0.402 0.303 0.105 0.324 0.514 0.219 0.027 0.025 0.552 0.107 0.028 0.384 0.124 0.669 0.185 0.215 1.199 Neoglucobrassicin 0.024 0.040 0.075 0.041 0.035 0.020 0.358 0.145 0.114 0.098 0.074 0.123 0.056 0.070 0.028 0.037 0.025 0.019 1.178 0.827 0.670 0.382 0.773 1.060 0.528 0.156 0.105 1.094 0.240 0.124 0.777 0.242 1.081 0.338 0.311 1.199 Sinalbin 0.000 0.000 0.005 0.000 0.000 0.000 0.059 0.000 0.004 0.004 0.009 0.031 0.019 0.008 0.004 0.005 0.003 0.000 0.242 0.315 0.028 0.047 0.363 0.763 0.106 0.000 0.016 0.336 0.083 0.056 0.277 0.017 0.664 0.084 0.076 1.199 metabolite_name quanitfied m/z PubChemID KEGG ID 4-Hydroxyglucobrassicin 463.04865 656561 C08422 Glucobrassicin 447.05374 6602378 C05837 Gluconapin 372.04284 9548620 C08415 Gluconasturtiin 422.05849 9548618 C08417 Neoglucobrassicin 477.0643 5485217 C08424 Sinalbin 424.03776 656568 C08426