Exact Mass: 1004.5191830000001
Exact Mass Matches: 1004.5191830000001
Found 19 metabolites which its exact mass value is equals to given mass value 1004.5191830000001,
within given mass tolerance error 4.0E-5 dalton. Try search metabolite list with more accurate mass tolerance error
8.0E-6 dalton.
23-O-beta-xylopyranosyl-(5beta,25S)-spirostan-3beta,23alpha-diol-3-O-beta-xylopyranosyl(1->2)-[alpha-rhamnopyranosyl-(1->4)]-beta-glucopyranoside|filiasparoside E
C49H80O21 (1004.5191830000001)
3-O--beta-glucopyranosyl-(1-4)-beta-galactopyranosyl>-neotigogenin|3-O-[beta-xylopyranosyl-(1-2)-(beta-xylopyranosyl-(1-3))-beta-glucopyranosyl-(1-4)-beta-galactopyranosyl]-neotigogenin
C49H80O21 (1004.5191830000001)
26-O-beta-glucopyranosyl-(5beta,25S)-furost-20(22)-ene-3beta,26-diol-3-O-beta-xylopyranosyl(1->4)-[alpha-arabinopyranosyl(1->6)]-beta-glucopyranoside|filiasparoside G
C49H80O21 (1004.5191830000001)
2-{4-[16-({3,4-dihydroxy-5-[(3,4,5-trihydroxyoxan-2-yl)oxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl}oxy)-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-6-en-6-yl]-2-methylbutoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C49H80O21 (1004.5191830000001)
(3s)-1-[(1s,4r,5r,6s,7s,9s,11s,12s,15r,17s,20r)-17-{[(2r,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-9-methoxy-4,6,11,16,16-pentamethyl-8-oxahexacyclo[10.9.0.0¹,²⁰.0⁴,¹¹.0⁵,⁹.0¹⁵,²⁰]henicosan-7-yl]-3-hydroxy-3-methyl-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-2-one
C49H80O21 (1004.5191830000001)
aquilegioside e
C49H80O21 (1004.5191830000001)
{"Ingredient_id": "HBIN016551","Ingredient_name": "aquilegioside e","Alias": "NA","Ingredient_formula": "C49H80O21","Ingredient_Smile": "CC1C(OC2(C1C3(CCC45CC46CCC(C(C6CCC5C3(C2)C)(C)C)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)OC)CC(=O)C(C)(COC9C(C(C(C(O9)CO)O)O)O)O","Ingredient_weight": "1005.1 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1546","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101243283","DrugBank_id": "NA"}
asparacoside
C49H80O21 (1004.5191830000001)
{"Ingredient_id": "HBIN017091","Ingredient_name": "asparacoside","Alias": "NA","Ingredient_formula": "C49H80O21","Ingredient_Smile": "CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)COC8C(C(C(CO8)O)O)O)OC9C(C(C(CO9)O)O)O)O)OC2C(C(C(C(O2)CO)O)O)O)C)C)C)OC1","Ingredient_weight": "1005.1 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1863","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "21575006","DrugBank_id": "NA"}
2-{[4-hydroxy-2-(hydroxymethyl)-6-{5,7',9',13'-tetramethyl-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane]oxy}-5-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
C49H80O21 (1004.5191830000001)
1-[(1s,4r,5r,6s,7s,9s,11s,12s,15r,17s,20r)-17-{[(2r,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-9-methoxy-4,6,11,16,16-pentamethyl-8-oxahexacyclo[10.9.0.0¹,²⁰.0⁴,¹¹.0⁵,⁹.0¹⁵,²⁰]henicosan-7-yl]-3-hydroxy-3-methyl-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-2-one
C49H80O21 (1004.5191830000001)
(2r,3r,4s,5s,6r)-2-[(2s)-4-[(1r,2s,4s,8s,9s,12s,13s,16s,18r)-16-{[(2r,3r,4r,5s,6r)-3,4-dihydroxy-5-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-6-en-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
C49H80O21 (1004.5191830000001)
6-[(6-{[10-butyl-4,5,23-trihydroxy-24-(hydroxymethyl)-6-methyl-20-oxo-2,7,9,21,25-pentaoxatricyclo[20.3.1.0³,⁸]hexacosan-26-yl]oxy}-4-hydroxy-2-methyl-5-[(2-methylbut-2-enoyl)oxy]oxan-3-yl)oxy]-4,5-dihydroxy-2-methyloxan-3-yl 2-methylbut-2-enoate
C49H80O21 (1004.5191830000001)
(3r)-1-[(1s,4r,5r,6s,7s,9s,11s,12s,15r,17s,20r)-17-{[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-9-methoxy-4,6,11,16,16-pentamethyl-8-oxahexacyclo[10.9.0.0¹,²⁰.0⁴,¹¹.0⁵,⁹.0¹⁵,²⁰]henicosan-7-yl]-3-hydroxy-3-methyl-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-2-one
C49H80O21 (1004.5191830000001)
1-(17-{[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-9-methoxy-4,6,11,16,16-pentamethyl-8-oxahexacyclo[10.9.0.0¹,²⁰.0⁴,¹¹.0⁵,⁹.0¹⁵,²⁰]henicosan-7-yl)-3-hydroxy-3-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-2-one
C49H80O21 (1004.5191830000001)
2-[(4-hydroxy-2-{5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane]oxy}-5-[(3,4,5-trihydroxyoxan-2-yl)oxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
C49H80O21 (1004.5191830000001)
(2s,3r,4s,5s,6r)-2-{[(2r,3r,4s,5s,6r)-4-hydroxy-2-[(1'r,2r,2's,4's,5s,7's,8'r,9's,12's,13's,16's,18'r)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane]oxy]-5-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C49H80O21 (1004.5191830000001)
(2s,3r,4r,5r,6s)-2-{[(2r,3s,4s,5r,6r)-4-hydroxy-2-(hydroxymethyl)-6-[(1'r,2s,2's,3s,4's,5s,7's,8'r,9's,12's,13's,16's,18'r)-5,7',9',13'-tetramethyl-3-{[(2r,3s,4r,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane]oxy]-5-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
C49H80O21 (1004.5191830000001)
(3r)-1-[(1s,4r,5r,6s,7s,9s,11s,12s,15r,17s,20r)-17-{[(2r,3r,4s,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-9-methoxy-4,6,11,16,16-pentamethyl-8-oxahexacyclo[10.9.0.0¹,²⁰.0⁴,¹¹.0⁵,⁹.0¹⁵,²⁰]henicosan-7-yl]-3-hydroxy-3-methyl-4-{[(2r,3r,4s,5s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-2-one
C49H80O21 (1004.5191830000001)
