Exact Mass: 1164.5873694
Exact Mass Matches: 1164.5873694
Found 20 metabolites which its exact mass value is equals to given mass value 1164.5873694,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
20-O-[(beta-D-glucopyranosyl-(1->6)-beta-glucopyranosyl-(1->2)-beta-D-digitalopyranosyl)oxy]pregn-5-en-16alpha-ol-3beta-yl O-(2-O-acetyl-beta-D-digitalopyranosyl)-(1->4)-beta-D-cymaropyranoside|Delta5-pregnene-3beta,16alpha,20(S)-triol 3-O-<2-O-acetyl-beta-D-digitalopyranosyl(1 -> 4)-beta-D-cymaropyranoside> 20-O- 6)-beta-D-glucopyranosyl(1 -> 2)-beta-D-digitalopyranoside|Delta5-pregnene-3beta,16alpha,20(S)-triol 3-O-[2-O-acetyl-beta-D-digitalopyranosyl(1 -> 4)-beta-D-cymaropyranoside] 20-O-[beta-D-glucopyranosyl-(1 -> 6)-beta-D-glucopyranosyl(1 -> 2)-beta-D-digitalopyranoside|glycoside H2
20-O-[(beta-D-glucopyranosyl-(1->6)-beta-glucopyranosyl-(1->2)-beta-D-digitalopyranosyl)oxy]pregn-5-en-16alpha-ol-3beta-yl O-(2-O-acetyl-beta-D-digitalopyranosyl)-(1->4)-beta-D-cymaropyranoside|Delta5-pregnene-3beta,16alpha,20(S)-triol 3-O-<2-O-acetyl-beta-D-digitalopyranosyl(1 -> 4)-beta-D-cymaropyranoside> 20-O- 6)-beta-D-glucopyranosyl(1 -> 2)-beta-D-digitalopyranoside|Delta5-pregnene-3beta,16alpha,20(S)-triol 3-O-[2-O-acetyl-beta-D-digitalopyranosyl(1 -> 4)-beta-D-cymaropyranoside] 20-O-[beta-D-glucopyranosyl-(1 -> 6)-beta-D-glucopyranosyl(1 -> 2)-beta-D-digitalopyranoside|glycoside H2
Malonylginsenoside Rc
Malonylginsenoside Rc
Malonylginsenoside Rc is a natural product found in Panax quinquefolius with data available.
5-hydroxy-2-({6-[(2-hydroxy-1-{1-[(5-hydroxy-4-methoxy-6-methyl-3-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl)oxy]ethyl}-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl)oxy]-4-methoxy-2-methyloxan-3-yl}oxy)-4-methoxy-6-methyloxan-3-yl acetate
5-hydroxy-2-({6-[(2-hydroxy-1-{1-[(5-hydroxy-4-methoxy-6-methyl-3-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl)oxy]ethyl}-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl)oxy]-4-methoxy-2-methyloxan-3-yl}oxy)-4-methoxy-6-methyloxan-3-yl acetate
3-({6-[(2-{[1-(2-{[6-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-6-methylhept-5-en-2-yl)-11-hydroxy-3a,3b,6,6,9a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthren-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methoxy)-3-oxopropanoic acid
3-({6-[(2-{[1-(2-{[6-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-6-methylhept-5-en-2-yl)-11-hydroxy-3a,3b,6,6,9a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthren-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methoxy)-3-oxopropanoic acid
5-pregnene-3β,16α,20α-triol
NA
{"Ingredient_id": "HBIN011881","Ingredient_name": "5-pregnene-3\u03b2,16\u03b1,20\u03b1-triol","Alias": "NA","Ingredient_formula": "C56H92O25","Ingredient_Smile": "CC1C(C(C(C(O1)OC(C)C2C(CC3C2(CCC4C3CC=C5C4(CCC(C5)OC6CC(C(C(O6)C)OC7C(C(C(C(O7)C)O)OC)OC(=O)C)OC)C)C)O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "17788","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-{[(2r,3s,4s,5r,6s)-6-{[(2r,3r,4s,5s,6r)-2-{[(1r,3ar,3br,5ar,7s,9ar,9bs,11r,11ar)-11-hydroxy-3a,3b,6,6,9a-pentamethyl-1-[(2s)-6-methyl-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}hept-5-en-2-yl]-dodecahydro-1h-cyclopenta[a]phenanthren-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-3-oxopropanoic acid
3-{[(2r,3s,4s,5r,6s)-6-{[(2r,3r,4s,5s,6r)-2-{[(1r,3ar,3br,5ar,7s,9ar,9bs,11r,11ar)-11-hydroxy-3a,3b,6,6,9a-pentamethyl-1-[(2s)-6-methyl-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}hept-5-en-2-yl]-dodecahydro-1h-cyclopenta[a]phenanthren-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-3-oxopropanoic acid
(2s,3r,4s,5s,6r)-2-{[(2r,3r,4s,6r)-6-{[(1r,2r,3as,3bs,7s,9ar,9bs,11as)-2-hydroxy-1-[(1s)-1-{[(2r,3r,4s,5s,6r)-5-hydroxy-4-methoxy-6-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl]oxy}ethyl]-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl]oxy}-4-methoxy-2-methyloxan-3-yl]oxy}-5-hydroxy-4-methoxy-6-methyloxan-3-yl acetate
(2s,3r,4s,5s,6r)-2-{[(2r,3r,4s,6r)-6-{[(1r,2r,3as,3bs,7s,9ar,9bs,11as)-2-hydroxy-1-[(1s)-1-{[(2r,3r,4s,5s,6r)-5-hydroxy-4-methoxy-6-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl]oxy}ethyl]-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl]oxy}-4-methoxy-2-methyloxan-3-yl]oxy}-5-hydroxy-4-methoxy-6-methyloxan-3-yl acetate
(2s,3r,4s,5s,6r)-2-{[(2r,3r,4s,6r)-6-{[(1r,2s,3as,3bs,7s,9ar,9bs,11as)-2-hydroxy-1-[(1s)-1-{[(2r,3r,4s,5s,6r)-5-hydroxy-4-methoxy-6-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl]oxy}ethyl]-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl]oxy}-4-methoxy-2-methyloxan-3-yl]oxy}-5-hydroxy-4-methoxy-6-methyloxan-3-yl acetate
(2s,3r,4s,5s,6r)-2-{[(2r,3r,4s,6r)-6-{[(1r,2s,3as,3bs,7s,9ar,9bs,11as)-2-hydroxy-1-[(1s)-1-{[(2r,3r,4s,5s,6r)-5-hydroxy-4-methoxy-6-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl]oxy}ethyl]-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl]oxy}-4-methoxy-2-methyloxan-3-yl]oxy}-5-hydroxy-4-methoxy-6-methyloxan-3-yl acetate
(2s,3r,4s,5s,6r)-2-{[(2r,3r,4s,6r)-6-{[(1r,2s,3as,3bs,7s,9ar,9bs,11as)-2-hydroxy-1-[(1r)-1-{[(2r,3r,4s,5s,6r)-5-hydroxy-4-methoxy-6-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl]oxy}ethyl]-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl]oxy}-4-methoxy-2-methyloxan-3-yl]oxy}-5-hydroxy-4-methoxy-6-methyloxan-3-yl acetate
(2s,3r,4s,5s,6r)-2-{[(2r,3r,4s,6r)-6-{[(1r,2s,3as,3bs,7s,9ar,9bs,11as)-2-hydroxy-1-[(1r)-1-{[(2r,3r,4s,5s,6r)-5-hydroxy-4-methoxy-6-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl]oxy}ethyl]-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl]oxy}-4-methoxy-2-methyloxan-3-yl]oxy}-5-hydroxy-4-methoxy-6-methyloxan-3-yl acetate
3-{[(2r,3s,4s,5r,6s)-6-{[(2r,3r,4s,5s,6r)-2-{[(1s,3ar,3br,5ar,7s,9ar,9br,11r,11ar)-1-[(2s)-2-{[(2s,3r,4s,5s,6r)-6-({[(2r,3r,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-6-methylhept-5-en-2-yl]-11-hydroxy-3a,3b,6,6,9a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthren-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-3-oxopropanoic acid
3-{[(2r,3s,4s,5r,6s)-6-{[(2r,3r,4s,5s,6r)-2-{[(1s,3ar,3br,5ar,7s,9ar,9br,11r,11ar)-1-[(2s)-2-{[(2s,3r,4s,5s,6r)-6-({[(2r,3r,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-6-methylhept-5-en-2-yl]-11-hydroxy-3a,3b,6,6,9a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthren-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-3-oxopropanoic acid
3-{[6-({4,5-dihydroxy-2-[(11-hydroxy-3a,3b,6,6,9a-pentamethyl-1-{6-methyl-2-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]hept-5-en-2-yl}-dodecahydro-1h-cyclopenta[a]phenanthren-7-yl)oxy]-6-(hydroxymethyl)oxan-3-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methoxy}-3-oxopropanoic acid
3-{[6-({4,5-dihydroxy-2-[(11-hydroxy-3a,3b,6,6,9a-pentamethyl-1-{6-methyl-2-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]hept-5-en-2-yl}-dodecahydro-1h-cyclopenta[a]phenanthren-7-yl)oxy]-6-(hydroxymethyl)oxan-3-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methoxy}-3-oxopropanoic acid
3-{[(2r,3s,4s,5r,6s)-6-{[(2r,3r,4s,5s,6r)-2-{[(1r,3ar,3br,5ar,7s,9ar,9bs,11r,11ar)-1-[(2s)-2-{[(2s,3r,4s,5s,6r)-6-({[(2r,3r,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-6-methylhept-5-en-2-yl]-11-hydroxy-3a,3b,6,6,9a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthren-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-3-oxopropanoic acid
3-{[(2r,3s,4s,5r,6s)-6-{[(2r,3r,4s,5s,6r)-2-{[(1r,3ar,3br,5ar,7s,9ar,9bs,11r,11ar)-1-[(2s)-2-{[(2s,3r,4s,5s,6r)-6-({[(2r,3r,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-6-methylhept-5-en-2-yl]-11-hydroxy-3a,3b,6,6,9a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthren-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-3-oxopropanoic acid
(2r,3r,4s,5r,6r)-2-{[(1s,3r,4s,5s,6r,8r,10s,22s,23r,24r,26r)-26-{[(2s,3r,4r,5r,6s)-4,5-dihydroxy-6-methyl-3-{[(2e)-2-methylbut-2-enoyl]oxy}oxan-2-yl]oxy}-4,5,23-trihydroxy-6-methyl-20-oxo-10-pentyl-2,7,9,21,25-pentaoxatricyclo[20.3.1.0³,⁸]hexacosan-24-yl]methoxy}-5-hydroxy-6-methyl-3-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-4-yl (2e)-2-methylbut-2-enoate
(2r,3r,4s,5r,6r)-2-{[(1s,3r,4s,5s,6r,8r,10s,22s,23r,24r,26r)-26-{[(2s,3r,4r,5r,6s)-4,5-dihydroxy-6-methyl-3-{[(2e)-2-methylbut-2-enoyl]oxy}oxan-2-yl]oxy}-4,5,23-trihydroxy-6-methyl-20-oxo-10-pentyl-2,7,9,21,25-pentaoxatricyclo[20.3.1.0³,⁸]hexacosan-24-yl]methoxy}-5-hydroxy-6-methyl-3-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-4-yl (2e)-2-methylbut-2-enoate
4,5-dihydroxy-6-methyl-2-({4,5,23-trihydroxy-24-[({5-hydroxy-6-methyl-4-[(2-methylbut-2-enoyl)oxy]-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-6-methyl-20-oxo-10-pentyl-2,7,9,21,25-pentaoxatricyclo[20.3.1.0³,⁸]hexacosan-26-yl}oxy)oxan-3-yl 2-methylbut-2-enoate
4,5-dihydroxy-6-methyl-2-({4,5,23-trihydroxy-24-[({5-hydroxy-6-methyl-4-[(2-methylbut-2-enoyl)oxy]-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-6-methyl-20-oxo-10-pentyl-2,7,9,21,25-pentaoxatricyclo[20.3.1.0³,⁸]hexacosan-26-yl}oxy)oxan-3-yl 2-methylbut-2-enoate
methyl 11-{[(2r,3r,4s,5s,6r)-3-{[(2s,3r,4s,5s,6r)-3-{[(2s,3r,4s,5r,6s)-4-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]methyl}-3-hydroxy-6-methyl-5-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,5-dihydroxy-6-methyloxan-2-yl]oxy}tetradecanoate
methyl 11-{[(2r,3r,4s,5s,6r)-3-{[(2s,3r,4s,5s,6r)-3-{[(2s,3r,4s,5r,6s)-4-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]methyl}-3-hydroxy-6-methyl-5-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,5-dihydroxy-6-methyloxan-2-yl]oxy}tetradecanoate