Exact Mass: 872.5227
Exact Mass Matches: 872.5227
Found 22 metabolites which its exact mass value is equals to given mass value 872.5227,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Semduramicin
2-{2,4-dihydroxy-6-[1-(9-hydroxy-2-{5-[5-(6-hydroxy-3,5,6-trimethyloxan-2-yl)-3-[(5-methoxy-6-methyloxan-2-yl)oxy]oxolan-2-yl]-5-methyloxolan-2-yl}-2,8-dimethyl-1,6-dioxaspiro[4.5]decan-7-yl)ethyl]-5-methoxy-3-methyloxan-2-yl}acetic acid
7,8-dihydroxuxuarine Dbeta|7,8-Dihydroxuxuarine D??
7,8-dihydroxuxuarine Dbeta|7,8-Dihydroxuxuarine D??
Semduramicin
Semduramicin
C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent
cyclo[N(Me)Leu-D-OAla-N(Me)Leu-D-OAla-N(Me)Leu-D-OAla-N(Me)Leu-D-OPhe]
cyclo[N(Me)Leu-D-OAla-N(Me)Leu-D-OAla-N(Me)Leu-D-OAla-N(Me)Leu-D-OPhe]
2-[(2R,4S,5R)-2,4-dihydroxy-6-[(1R)-1-[(2S,5R,7S,8R,9S)-7-hydroxy-2-[(2R,5S)-5-[(2R,3S,5R)-5-[(2S,3S,5R,6S)-6-hydroxy-3,5,6-trimethyloxan-2-yl]-3-[(2S,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxyoxolan-2-yl]-5-methyloxolan-2-yl]-2,8-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]ethyl]-5-methoxy-3-methyloxan-2-yl]acetic acid
2-[(2R,4S,5R)-2,4-dihydroxy-6-[(1R)-1-[(2S,5R,7S,8R,9S)-7-hydroxy-2-[(2R,5S)-5-[(2R,3S,5R)-5-[(2S,3S,5R,6S)-6-hydroxy-3,5,6-trimethyloxan-2-yl]-3-[(2S,5S,6R)-5-methoxy-6-methyloxan-2-yl]oxyoxolan-2-yl]-5-methyloxolan-2-yl]-2,8-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]ethyl]-5-methoxy-3-methyloxan-2-yl]acetic acid
1,3-(8R,9R-epoxy-octadec-13Z,15Z-dien-4,6-diynoyl)-2-(9,12-octadecadiynoyl)-sn-glycerol
1,3-(8R,9R-epoxy-octadec-13Z,15Z-dien-4,6-diynoyl)-2-(9,12-octadecadiynoyl)-sn-glycerol
(5z,9e,14z)-11-{[(4z,9e)-15-carboxy-8,11-dihydroxypentadeca-4,9-dien-7-yl]oxy}-8-{[6-(2,3-dihydroxypropoxy)-3,4,5-trihydroxyoxan-2-yl]methoxy}-12-hydroxyicosa-5,9,14-trienoic acid
(5z,9e,14z)-11-{[(4z,9e)-15-carboxy-8,11-dihydroxypentadeca-4,9-dien-7-yl]oxy}-8-{[6-(2,3-dihydroxypropoxy)-3,4,5-trihydroxyoxan-2-yl]methoxy}-12-hydroxyicosa-5,9,14-trienoic acid
(2s,3r,4s,5r)-2-{[(3r,3as,4s,5ar,5br,7s,7ar,9s,11ar,11br,13ar,13br)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-7,9-bis({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy})-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
(2s,3r,4s,5r)-2-{[(3r,3as,4s,5ar,5br,7s,7ar,9s,11ar,11br,13ar,13br)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-7,9-bis({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy})-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
7',8'-dihydroxuxuarine dβ
NA
{"Ingredient_id": "HBIN012970","Ingredient_name": "7',8'-dihydroxuxuarine d\u03b2","Alias": "NA","Ingredient_formula": "C56H72O8","Ingredient_Smile": "CC1CC2C(CCC3(C2(CCC4(C3=CC=C5C4=CC(=O)C6(C5(OC7=C(O6)C=C8C(=C7C)C(=O)CC9C8(CCC2(C9(CCC3(C2CC(C(=O)C3O)C)C)C)C)C)C)O)C)C)C)(CC1=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5744","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2s,3r,4s,5r)-2-{[(3r,3as,4s,5ar,5br,7s,7ar,9s,11ar,11br,13ar,13br)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-9-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-7-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
(2s,3r,4s,5r)-2-{[(3r,3as,4s,5ar,5br,7s,7ar,9s,11ar,11br,13ar,13br)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-9-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-7-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
(2s,3r,4s,5r)-2-{[(3s,3as,4s,5ar,5br,7s,7ar,9s,11ar,11br,13ar,13br)-9-{[(2s,3r,4s,5s)-3,5-dihydroxy-4-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-7-hydroxy-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
(2s,3r,4s,5r)-2-{[(3s,3as,4s,5ar,5br,7s,7ar,9s,11ar,11br,13ar,13br)-9-{[(2s,3r,4s,5s)-3,5-dihydroxy-4-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-7-hydroxy-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
(2r,3s,4r,5r)-2-{[(3r,3ar,4s,5ar,5br,7r,7as,9r,11ar,11bs,13ar,13br)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-7-{[(2r,3s,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-9-{[(2s,3r,4r,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
(2r,3s,4r,5r)-2-{[(3r,3ar,4s,5ar,5br,7r,7as,9r,11ar,11bs,13ar,13br)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-7-{[(2r,3s,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-9-{[(2s,3r,4r,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
(2s,3r,4s,5r)-2-{[(3s,3as,4s,5ar,5br,7s,7ar,9s,11ar,11br,13ar,13br)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-9-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-7-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
(2s,3r,4s,5r)-2-{[(3s,3as,4s,5ar,5br,7s,7ar,9s,11ar,11br,13ar,13br)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-9-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-7-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
(2s,3r,4s,5r)-2-{[(3s,3as,4s,5ar,5br,7s,7ar,9s,11ar,11br,13ar,13br)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-7,9-bis({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy})-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
(2s,3r,4s,5r)-2-{[(3s,3as,4s,5ar,5br,7s,7ar,9s,11ar,11br,13ar,13br)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-7,9-bis({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy})-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
(2s,3r,4s,5s)-2-{[(3s,3as,4s,5ar,5br,7s,7ar,9s,11ar,11br,13ar,13br)-9-{[(2s,3r,4s,5s)-3,5-dihydroxy-4-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-7-hydroxy-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
(2s,3r,4s,5s)-2-{[(3s,3as,4s,5ar,5br,7s,7ar,9s,11ar,11br,13ar,13br)-9-{[(2s,3r,4s,5s)-3,5-dihydroxy-4-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-7-hydroxy-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
2-{[3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-7,9-bis[(3,4,5-trihydroxyoxan-2-yl)oxy]-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
2-{[3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-7,9-bis[(3,4,5-trihydroxyoxan-2-yl)oxy]-hexadecahydrocyclopenta[a]chrysen-4-yl]oxy}oxane-3,4,5-triol
