Exact Mass: 476.1076

Exact Mass Matches: 476.1076

Found 5 metabolites which its exact mass value is equals to given mass value 476.1076, within given mass tolerance error 0.001 dalton. Try search metabolite list with more accurate mass tolerance error 0.0002 dalton.

8-methylthiooctyl glucosinolate

[9-(Methylsulphanyl)-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulphanyl}nonylidene]amino sulphuric acid

C16H30NO9S3 (476.1083)


8-methylthiooctyl glucosinolate is practically insoluble (in water) and an extremely strong acidic compound (based on its pKa). 8-methylthiooctyl glucosinolate can be found in a number of food items such as mandarin orange (clementine, tangerine), rosemary, cottonseed, and poppy, which makes 8-methylthiooctyl glucosinolate a potential biomarker for the consumption of these food products.

   

(5S,5aS,7aR,12S,12aS,14aR)-5,5a,7a,8,12,12a,14a,15-octahydro-12-hydroxy-7a,14a-bis(methylsulfanyl)-7,14-dioxo-7H,14H-oxepino[3,4: 4,5]pyrrolo-[1,2: 4,5]pyrazino[1,2-a]indol-5-yl acetate

(5S,5aS,7aR,12S,12aS,14aR)-5,5a,7a,8,12,12a,14a,15-octahydro-12-hydroxy-7a,14a-bis(methylsulfanyl)-7,14-dioxo-7H,14H-oxepino[3,4: 4,5]pyrrolo-[1,2: 4,5]pyrazino[1,2-a]indol-5-yl acetate

C22H24N2O6S2 (476.1076)


   

8-(Methylthio)octyl-glucosinolate

8-(Methylthio)octyl-glucosinolate

C16H30NO9S3- (476.1083)


   

[(Z)-[9-methylsulfanyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylnonylidene]amino] sulfate

[(Z)-[9-methylsulfanyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylnonylidene]amino] sulfate

C16H30NO9S3- (476.1083)


   

(1r,4s,5s,11r,14s,15s)-5-hydroxy-1,11-bis(methylsulfanyl)-2,12-dioxo-18-oxa-3,13-diazapentacyclo[11.8.0.0³,¹¹.0⁴,⁹.0¹⁴,²⁰]henicosa-6,8,16,19-tetraen-15-yl acetate

(1r,4s,5s,11r,14s,15s)-5-hydroxy-1,11-bis(methylsulfanyl)-2,12-dioxo-18-oxa-3,13-diazapentacyclo[11.8.0.0³,¹¹.0⁴,⁹.0¹⁴,²⁰]henicosa-6,8,16,19-tetraen-15-yl acetate

C22H24N2O6S2 (476.1076)