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. 2005 Jan 21;102(5):1779–1784. doi: 10.1073/pnas.0409233102

Table 1.

Metabolic profiling of wild-type and transgenic A. thaliana lines as monitored by extracted ion chromatography from LC-MS (Fig. 2)

No. Metabolite rt, min [M+Na]+ M+ 1x 2x 3x wt
1 p-glucosyloxy-benzylglucose* 2.5 485 462 - + - -
3.4 485 462 - + - -
4.1 485 462 - ++ - -
2 p-glucosyloxy-phenylmethanol* 11.7 309 286 - + - -
3 p-glucosyloxy-benzoic acid* 5.8 323 300 - + - -
4 p-glucosyloxy-phenylethanol 10.3 323 300 + + - -
5 p-hydroxybenzoylglucose* 11.1 323 300 - +++ + -
6 Dhurrin* 13.5 334 311 - - +++ -
7 p-hydroxybenzylglucosionolate 4.0 368 345 +++ + - -
8 Desulfo p-hydroxybenzylglucosinolate 6.5 368 345 +++ + - -
9 Unknown glucoside 12.0 337 314 ++ + + -
10 Unknown compound 14.2 - 323 + + - -
11 Unknown compound 7.7 - 323 - + - -
12 Unknown 13.7 316 +++ + +++ +++
Unknown 14.3 - 316 +++ ++ +++ +++
Unknown 15.5 316 +++ ++++ +++ +++
13 Sinapoyl malate 23.2 363 339 +++ + +++ +++
14 Sinapoyl glucose 18.4 409 385 + + +++ +++
15 Kaempferol-3-O-glucoside-7-O-rhamnoside 22.0 617 594 ++ + ++ ++
16 Kaempferol-3-O-rhamnoside-7-O-rhamnoside 23.6 601 578 ++ + ++ ++
17 Kaempferol-3-O-[rhamnosyl(1→2)glucoside]-7-O-rhamnoside 19.7 763 740 ++ + ++ ++

+, Metabolite present with relative amounts indicated by the number of plus signs. -, metabolite was not detected; rt, retention time.

*

Metabolites marked derived from p-hydroxyphenylacetaldoxime.

Metabolites marked derived from p-hydroxymandelonitrile (6).