Exact Mass: 594.3767634

Exact Mass Matches: 594.3767634

Found 46 metabolites which its exact mass value is equals to given mass value 594.3767634, within given mass tolerance error 0.0002 dalton. Try search metabolite list with more accurate mass tolerance error 4.0E-5 dalton.

Capsicoside A1

2-(hydroxymethyl)-6-{5,7,9,13-tetramethyl-5-oxaspiro[oxane-2,6-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane]-15-oloxy}oxane-3,4,5-triol

C33H54O9 (594.3767634)


Capsicoside a1 is a member of the class of compounds known as steroidal saponins. Steroidal saponins are saponins in which the aglycone moiety is a steroid. The steroidal aglycone is usually a spirostane, furostane, spirosolane, solanidane, or curcubitacin derivative. Capsicoside a1 is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Capsicoside a1 can be found in a number of food items such as red bell pepper, yellow bell pepper, pepper (c. annuum), and orange bell pepper, which makes capsicoside a1 a potential biomarker for the consumption of these food products.

   
   

Dioseptemloside B

Dioseptemloside B

C33H54O9 (594.3767634)


   

Furostane base -2H + O-Hex

Furostane base -2H + O-Hex

C33H54O9 (594.3767634)


Annotation level-3

   

16beta-[(beta-D-glucopyranosyl)oxy]-3beta,7beta-dihydroxycholest-5-en-23-one|16??-[(??-D-Glucopyranosyl)-oxy]-3??,7??-dihydroxycholest-5-en-23-one

16beta-[(beta-D-glucopyranosyl)oxy]-3beta,7beta-dihydroxycholest-5-en-23-one|16??-[(??-D-Glucopyranosyl)-oxy]-3??,7??-dihydroxycholest-5-en-23-one

C33H54O9 (594.3767634)


   

(25R)-6alpha-hydroxy-5alpha-spirostan-3beta-yl beta-D-glucopyranoside|chlorogenin 3beta-O-beta-D-glucopyranoside

(25R)-6alpha-hydroxy-5alpha-spirostan-3beta-yl beta-D-glucopyranoside|chlorogenin 3beta-O-beta-D-glucopyranoside

C33H54O9 (594.3767634)


   

2,22-deoxyecdysone 25-O-beta-D-glucopyranoside

2,22-deoxyecdysone 25-O-beta-D-glucopyranoside

C33H54O9 (594.3767634)


   
   
   

22-Epirhodeasapogenin-3-O-??-D-glucopyranoside

22-Epirhodeasapogenin-3-O-??-D-glucopyranoside

C33H54O9 (594.3767634)


   

11-O-Beta-D-Galactopyranoside-(3beta,5beta,11alpha,25R)-Spirostane-3,11-diol

11-O-Beta-D-Galactopyranoside-(3beta,5beta,11alpha,25R)-Spirostane-3,11-diol

C33H54O9 (594.3767634)


   

3beta,11alpha,16beta-trihydroxycholest-5,25(26)-dien-24-yl beta-D-glucopyranoside

3beta,11alpha,16beta-trihydroxycholest-5,25(26)-dien-24-yl beta-D-glucopyranoside

C33H54O9 (594.3767634)


   

(25S)-spirostane-3beta,5beta-diol 5-beta-D-glucopyranoside|reinocarnoside B

(25S)-spirostane-3beta,5beta-diol 5-beta-D-glucopyranoside|reinocarnoside B

C33H54O9 (594.3767634)


   

(25R)-3beta-hydroxy-5alpha-spirostan-1beta-yl beta-D-glucopyranoside

(25R)-3beta-hydroxy-5alpha-spirostan-1beta-yl beta-D-glucopyranoside

C33H54O9 (594.3767634)


   

6-O-(Glcb)-(25R)-5alpha-spirostan-3beta,6alpha-diol

(25R)-5alpha-spirostan-3beta,6alpha-diol 6-O-beta-D-glucopyranoside

C33H54O9 (594.3767634)


   

Furostane base-2H + O-Hex

Furostane base-2H + O-Hex

C33H54O9 (594.3767634)


   
   
   
   
   
   
   
   

2-(hydroxymethyl)-6-{5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-16'-oloxy}oxane-3,4,5-triol

2-(hydroxymethyl)-6-{5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-16'-oloxy}oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

2-(hydroxymethyl)-6-{5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-19'-oloxy}oxane-3,4,5-triol

2-(hydroxymethyl)-6-{5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-19'-oloxy}oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

(2r,3r,4s,5r,6r)-2-(hydroxymethyl)-6-[(1'r,2r,2's,4's,5r,7's,8'r,9's,12's,13's,15'r,16'r,18's)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-15'-oloxy]oxane-3,4,5-triol

(2r,3r,4s,5r,6r)-2-(hydroxymethyl)-6-[(1'r,2r,2's,4's,5r,7's,8'r,9's,12's,13's,15'r,16'r,18's)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-15'-oloxy]oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

22-epirhodeasapogenin-3-o-β-d-glucopyrano-side

NA

C33H54O9 (594.3767634)


{"Ingredient_id": "HBIN003728","Ingredient_name": "22-epirhodeasapogenin-3-o-\u03b2-d-glucopyrano-side","Alias": "NA","Ingredient_formula": "C33H54O9","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7004","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-(4,7-dihydroxy-9a,11a-dimethyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl)-6-methylheptan-4-one

2-(4,7-dihydroxy-9a,11a-dimethyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl)-6-methylheptan-4-one

C33H54O9 (594.3767634)


   

(2r,3r,4s,5s,6r)-2-[(2r)-4-[(1s,2s,4s,6r,7s,8r,9s,12s,13r,16s)-6,16-dihydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-18-en-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

(2r,3r,4s,5s,6r)-2-[(2r)-4-[(1s,2s,4s,6r,7s,8r,9s,12s,13r,16s)-6,16-dihydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-18-en-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

3-[(1r,2s,4ar,6s,8r,8as)-2-[(2s,3r,4s,5e)-4-hydroxy-3,5-dimethyl-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oct-5-en-1-yl]-1,3,6,8-tetramethyl-4a,5,6,7,8,8a-hexahydro-2h-naphthalen-1-yl]-3-oxopropanal

3-[(1r,2s,4ar,6s,8r,8as)-2-[(2s,3r,4s,5e)-4-hydroxy-3,5-dimethyl-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oct-5-en-1-yl]-1,3,6,8-tetramethyl-4a,5,6,7,8,8a-hexahydro-2h-naphthalen-1-yl]-3-oxopropanal

C33H54O9 (594.3767634)


   

2-(4-{6,16-dihydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-18-en-6-yl}-2-methylbutoxy)-6-(hydroxymethyl)oxane-3,4,5-triol

2-(4-{6,16-dihydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-18-en-6-yl}-2-methylbutoxy)-6-(hydroxymethyl)oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

(2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-[(1'r,2r,2's,4's,5r,7's,8'r,9's,12's,13'r,16's,18's,19's)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-19'-oloxy]oxane-3,4,5-triol

(2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-[(1'r,2r,2's,4's,5r,7's,8'r,9's,12's,13'r,16's,18's,19's)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-19'-oloxy]oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

(2r,3r,4s,5s,6r)-2-{[(1s,2s,4s,6r,7s,8r,9s,12s,13r,16s)-6-hydroxy-6-[(3r)-4-hydroxy-3-methylbutyl]-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-18-en-16-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

(2r,3r,4s,5s,6r)-2-{[(1s,2s,4s,6r,7s,8r,9s,12s,13r,16s)-6-hydroxy-6-[(3r)-4-hydroxy-3-methylbutyl]-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-18-en-16-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

3-[(1s,2r,4ar,6s,8s,8ar)-2-[(2s,3s,4r,5e)-4-hydroxy-3,5-dimethyl-2-{[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oct-5-en-1-yl]-1,3,6,8-tetramethyl-4a,5,6,7,8,8a-hexahydro-2h-naphthalen-1-yl]-3-oxopropanal

3-[(1s,2r,4ar,6s,8s,8ar)-2-[(2s,3s,4r,5e)-4-hydroxy-3,5-dimethyl-2-{[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oct-5-en-1-yl]-1,3,6,8-tetramethyl-4a,5,6,7,8,8a-hexahydro-2h-naphthalen-1-yl]-3-oxopropanal

C33H54O9 (594.3767634)


   

(2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-[(1'r,2r,2's,4's,5r,7's,8'r,9's,12's,13'r,16's,18's,19's)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-16'-oloxy]oxane-3,4,5-triol

(2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-[(1'r,2r,2's,4's,5r,7's,8'r,9's,12's,13'r,16's,18's,19's)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-16'-oloxy]oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

2-(hydroxymethyl)-6-{5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-15'-oloxy}oxane-3,4,5-triol

2-(hydroxymethyl)-6-{5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-15'-oloxy}oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

2-(hydroxymethyl)-6-{5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-14'-oloxy}oxane-3,4,5-triol

2-(hydroxymethyl)-6-{5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-14'-oloxy}oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

2-{[6-hydroxy-6-(4-hydroxy-3-methylbutyl)-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-18-en-16-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

2-{[6-hydroxy-6-(4-hydroxy-3-methylbutyl)-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-18-en-16-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

3-[(1r,2s,6s,8r)-2-[(2s,3r,4s,5e)-4-hydroxy-3,5-dimethyl-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oct-5-en-1-yl]-1,3,6,8-tetramethyl-4a,5,6,7,8,8a-hexahydro-2h-naphthalen-1-yl]-3-oxopropanal

3-[(1r,2s,6s,8r)-2-[(2s,3r,4s,5e)-4-hydroxy-3,5-dimethyl-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oct-5-en-1-yl]-1,3,6,8-tetramethyl-4a,5,6,7,8,8a-hexahydro-2h-naphthalen-1-yl]-3-oxopropanal

C33H54O9 (594.3767634)


   

3-[2-(4-hydroxy-3,5-dimethyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oct-5-en-1-yl)-1,3,6,8-tetramethyl-4a,5,6,7,8,8a-hexahydro-2h-naphthalen-1-yl]-3-oxopropanal

3-[2-(4-hydroxy-3,5-dimethyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oct-5-en-1-yl)-1,3,6,8-tetramethyl-4a,5,6,7,8,8a-hexahydro-2h-naphthalen-1-yl]-3-oxopropanal

C33H54O9 (594.3767634)


   

(2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-[(1's,2r,2's,4's,5r,7's,8'r,9's,12's,13's,14'r,16'r,18's)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-16'-oloxy]oxane-3,4,5-triol

(2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-[(1's,2r,2's,4's,5r,7's,8'r,9's,12's,13's,14'r,16'r,18's)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-16'-oloxy]oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

(2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-[(1's,2r,2's,4's,5s,7's,8'r,9's,12's,13's,14'r,16's,18's)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-14'-oloxy]oxane-3,4,5-triol

(2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-[(1's,2r,2's,4's,5s,7's,8'r,9's,12's,13's,14'r,16's,18's)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-14'-oloxy]oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

(2r,3r,4s,5s,6r)-2-[(2r)-4-[(1r,2s,4s,6r,7s,8r,9s,12s,13r,16s)-6,16-dihydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-18-en-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

(2r,3r,4s,5s,6r)-2-[(2r)-4-[(1r,2s,4s,6r,7s,8r,9s,12s,13r,16s)-6,16-dihydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-18-en-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C33H54O9 (594.3767634)


   

(1r,2s,3as,3br,7s,9ar,9bs,11as)-7-hydroxy-1-[(2s,3s)-3-hydroxy-6-methylheptan-2-yl]-9a,11a-dimethyl-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h-cyclopenta[a]phenanthren-11-one

(1r,2s,3as,3br,7s,9ar,9bs,11as)-7-hydroxy-1-[(2s,3s)-3-hydroxy-6-methylheptan-2-yl]-9a,11a-dimethyl-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h-cyclopenta[a]phenanthren-11-one

C33H54O9 (594.3767634)


   

(2r)-2-[(1r,2s,3as,3bs,4r,7s,9ar,9bs,11as)-4,7-dihydroxy-9a,11a-dimethyl-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-6-methylheptan-4-one

(2r)-2-[(1r,2s,3as,3bs,4r,7s,9ar,9bs,11as)-4,7-dihydroxy-9a,11a-dimethyl-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-6-methylheptan-4-one

C33H54O9 (594.3767634)