INSIDabcdef_:MS_0001MS_0001 Base peak Chromatogram UV Chromatogram Extracted Ion Chromatogram Desulphoprogoitrin C11H19NNaO7S [M+Na] Figure S1. LC-MS

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匾镌绚劳
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1 Desulphoprogoitrin C11H19NNaO7S [M+Na] Figure S1. LC-MS chromatograms and MS spectra of desulphoglucosinolates extracted from Chinese cabbage.

2 Desulphosinigrin C1H17NNaO6S [M+Na]

3 Desulphoglucoalyssin C13HNNaO7S2 [M+Na]

4 Desulphogluconapin C11H19NNaO6S1 [M+Na]

5 Desulpho4-hydroxyglucobrassicin C16H2NNaO7S1 [M+Na]

7 Desulphoglucobrassicanapin C12H21NNaO6S [M+Na]

8 Desulphoglucoerucin C12H23NNaO6S2 [M+Na]

9 Desulphoglucobrassicin C16H2NNaO6S [M+Na]

10 Desulpho-4-methoxyglucobrassicin C17H22N2NaO7S [M+Na]

11 Desulphogluconasturtiin C19H21NNaO6S [M+Na]

12 Desulphoneoglucobrassicin C17H22N2NaO7S [M+Na]

13 Figure S2. MS spectra of lipophilic compound standards. (1) C2, eicosanol (RT: 1.43 min); (2) C21, heneicosanol (RT: 1.98 min); (3) C22, docosanol (RT: 11. min); (4) C24, tetracosanol (RT: min); (5) 5α-cholestane (internal standard; RT: min); (6) δ-tocopherol (RT: min); (7) C26, hexacosanol (RT: min); (8) β-tocopherol (RT: min); (9) γ-tocopherol (RT: min); (1) C27, heptacosanol (RT: min); (11) δ-tocotrienol (RT: min); (12) C28, octacosanol (RT: 14.4 min); (13) γ-tocotrienol (RT: 14. min); (14) α-tocopherol (RT: min); (15) cholesterol (RT: min); (16) brassicasterol (RT: min); (17) α-tocotrienol (RT: min); (18) campesterol (RT: min); (19) C3, triacontanol (RT: min); (2) stigmasterol (RT: min); (21) β-sitosterol (RT: 16.2 min); (22) α-amyrin (RT: min)

14 Figure S2. (Continued)

15 mau 4nm Time (min) Figure S3. LC chromatogram of carotenoids extracted from Waldongcheonha. Peak: 1.violaxanthin; 2.antheraxanthin; 3.lutein; 4.trans-βapo-8 -carotenal (internal standard; 5. α-carotene ; 6.β-carotene

16 Table S1. Correlations among Glucosinolate, Lipophilic Compound and Pigment Contents of Chinese Cabbage metabolite Violaxantin Antheraxanthin Lutein α-carotene β-carotene Chlorophyll PRO SIN GAL GNA GBN GER 4-OHGBS GBS 4-OMGBS NGBS GST Violaxantin Antheraxanthin Lutein α-carotene β-carotene Chlorophyll PRO SIN GAL GNA GBN GER OHGBS GBS OMGBS NGBS GST c c c c c c c c α-amyrin Brassicasterol Campesterol Cholesterol β-sitosterol Stigmasterol α-tocopherol β-tocopherol γ-tocopherol δ-tocopherol α-tocotrienol γ-tocotrienol δ-tocotrienol PRO, progoitrin; SIN, sinigrin; GAL, glucoalyssin; GNA, gluconapin; GBN, glucobrassicanapin; GER, glucoerucin; 4-OHGBS, 4- hydroxyglucobrassicin; GBS, glucobrassicin; 4-OMGBS, 4-methoxyglucobrassicin; GST, gluconasturtiin; NGBS, neoglucobrassicin; c2, eicosanol; c21, heneicosanol; c22, docosanol; c23, tricosanol; c24, tetracosanol; c26, hexacosanol; c27, heptacosanol; c28, octacosanol; c3, triacontanol

17 Table S1. (Continued) metabolite c2 c21 c22 c24 c26 c27 c28 c3 α-amyrin Brassicasterol Campesterol Cholesterol β-sitosterol Stigmasterol α-tocopherol β-tocopherol γ-tocopherol δ-tocopherol α-tocotrienol γ-tocotrienol δ-tocotrienol Violaxantin Antheraxanthin Lutein α-carotene β-carotene Chlorophyll PRO SIN GAL GNA GBN GER OHGBS GBS OMGBS NGBS GST c c c c c c c c α-amyrin Brassicasterol Campesterol Cholesterol β-sitosterol Stigmasterol α-tocopherol β-tocopherol γ-tocopherol δ-tocopherol α-tocotrienol γ-tocotrienol δ-tocotrienol

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