Exact Mass: 524.1972
Exact Mass Matches: 524.1972
Found 204 metabolites which its exact mass value is equals to given mass value 524.1972
,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Ligustroside
Ligustroside is found in fruits. Ligustroside is found in olives (Olea europaea Found in olives (Olea europaea)
3-((2'-(Benzoylaminosulfonyl)biphenyl-4-yl)methyl)-2-ethyl-5,7-dimethyl-3H-imidazo(4,5-b)pyridine
[4a,7-dihydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-5-yl] (E)-3-(4-methoxyphenyl)prop-2-enoate
12-Ketone,3-O-beta-D-glucopyranoside-Gibberellin A26
erythro-1-(4-hydroxy-3-methoxyphenyl)-2-{2-hydroxy-4-[(Z)-3-glucosylprop-1-enyl]phenoxy}propane-1,3-diol|semitortoside A|semitortoside B|threo-1-(4-hydroxy-3-methoxyphenyl)-2-{2-hydroxy-4-[(Z)-3-glucosylprop-1-enyl]phenoxy}propane-1,3-diol
9alpha-hydroxygelsemiol 3-O-(4-trans-p-coumaroyl)-beta-D-glucopyranoside|verbenabraside B
6-O-trans-p-methoxycinnamoyl-5,7-bisdeoxycynanchoside
(7S,8S)-3-methoxyl-3-O-beta-D-glucopyrannosyl-4:8,5:7-diepoxyneolignan-4,9-diol
2-(4-hydroxyphenyl)ethyl 6-O-{[(2R*,3R*,4R*)-3-formyl-3,4-dihydro-5-(methoxycarbonyl)-2-methyl-2H-pyran-4-yl]acetyl}-beta-D-glucopyranoside
gelsemiol 3-O-(4-trans-caffeoyl)-beta-D-glucopyranoside|verbenabraside A
(-)-(7S,8R,7E)-4,7,9,3,9-pentahydroxy-3-methoxy-8-4-oxyneolign-7-ene-3-O-beta-D-glucopyranoside
(1S,2S)-1-phenylpropane-1,2-diol 2-O-beta-D-glucopyranoside pentaacetate
Ligstroside
Ligstroside is a secoiridoid glycoside that is the methyl ester of 3,4-dihydro-2H-pyran-5-carboxylic acid which is substituted at positions 2, 3, and 4 by hydroxy, ethylidene, and carboxymethyl groups, respectively and in which the anomeric hydroxy group at position 2 has been converted into its beta-D-glucoside and the carboxylic acid moiety of the carboxymethyl substituent has been converted to the corresponding 4-hydroxyphenethyl ester (the 2S,3E,4S stereoisomer). An important phenolic compound present in olive cultivars. It has a role as a plant metabolite and an antineoplastic agent. It is a secoiridoid glycoside, a methyl ester, a diester, a member of pyrans, a member of phenols and a beta-D-glucoside. Ligstroside is a natural product found in Jasminum officinale, Osmanthus heterophyllus, and other organisms with data available. A secoiridoid glycoside that is the methyl ester of 3,4-dihydro-2H-pyran-5-carboxylic acid which is substituted at positions 2, 3, and 4 by hydroxy, ethylidene, and carboxymethyl groups, respectively and in which the anomeric hydroxy group at position 2 has been converted into its beta-D-glucoside and the carboxylic acid moiety of the carboxymethyl substituent has been converted to the corresponding 4-hydroxyphenethyl ester (the 2S,3E,4S stereoisomer). An important phenolic compound present in olive cultivars.
ligstroside
[4a,7-dihydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-5-yl] (E)-3-(4-methoxyphenyl)prop-2-enoate_minor
[4a,7-dihydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-5-yl] (E)-3-(4-methoxyphenyl)prop-2-enoate_major
[4a,7-dihydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-5-yl] (E)-3-(4-methoxyphenyl)prop-2-enoate_98.9\\%
Cys Phe Gln Gln
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Gln Cys Phe Gln
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Vardenafil
D004791 - Enzyme Inhibitors > D010726 - Phosphodiesterase Inhibitors > D058986 - Phosphodiesterase 5 Inhibitors C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor > C2127 - cGMP Phosphodiesterase Inhibitor D000089162 - Genitourinary Agents > D064804 - Urological Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
1s,5s,6s-(-)-1,6-bis(diphenylphosphinoxy)spiro[4.4]nonane
2-Pyrrolidinone, 5-[[[(1S)-1-[[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]methyl]-1-phenyl-2-propen-1-yl]imino]methyl]-5-ethenyl-, (5R)-
N,N-[(3-Oxospiro[isobenzofuran-1(3H),9-[9H]xanthene]-3,6-diyl)bis[(methylimino)-2,1-ethanediyl]]bisacetamide
Benzo[3,4]fluoreno[2,1-b]pyran-13(3H)-one,3,3-bis(4-methoxyphenyl)-6,11-dimethyl
1r,5r,6r-(+)-1,6-bis(diphenylphosphinoxy)spiro[4.4]nonane
2-[[(2R,4S,5R)-5-[2-methyl-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-1-azabicyclo[2.2.2]octan-2-yl]methylcarbamoyl]benzoic acid
Gelsemiol-6-trans-caffeoyl-1-glucoside
A iridoid monoterpenoid isolated from the aerial parts of Verbena litoralis and shown to possess stimulating effects on nerve growth factor.
2-({[(2r,4s,5r)-5-{2-Methyl-6-[4-(trifluoromethyl)phenyl]-4-pyrimidinyl}-1-azabicyclo[2.2.2]oct-2-yl]methyl}carbamoyl)benzoic acid
methyl (5Z)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
[6-({4a,5,7-trihydroxy-7-methyl-1h,5h,6h,7ah-cyclopenta[c]pyran-1-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-methoxyphenyl)prop-2-enoate
methyl (4s,5e,6s)-5-ethylidene-4-{2-[2-(2-hydroxyethyl)phenoxy]-2-oxoethyl}-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylate
methyl (4s,5e,6s)-5-ethylidene-4-{2-[4-(2-hydroxyethyl)phenoxy]-2-oxoethyl}-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylate
[(2r,3s,4s,5r,6s)-6-{[(1s,4as,5r,7s,7ar)-4a,5,7-trihydroxy-7-methyl-1h,5h,6h,7ah-cyclopenta[c]pyran-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl (2e)-3-(4-methoxyphenyl)prop-2-enoate
[(1s,3s,4s)-4-formyl-3-hydroxy-4-[(1z)-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethenyl]cyclohexyl]methyl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate
7-hydroxy-7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-5-yl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
4,5-dihydroxy-6-{[4-hydroxy-4-(hydroxymethyl)-5-methyl-2-oxo-tetrahydro-3h-cyclopenta[b]furan-3-yl]methoxy}-2-(hydroxymethyl)oxan-3-yl 3-(4-hydroxyphenyl)prop-2-enoate
(2s,6r)-13'-hydroxy-5'-methoxy-6-methyl-7'-(2-oxoheptyl)-2',10',16'-trioxaspiro[oxane-2,17'-tetracyclo[9.8.0.0³,⁸.0¹⁴,¹⁹]nonadecane]-1'(19'),3'(8'),4',6',11',13'-hexaene-9',15'-dione
2-hydroxy-4,6-dimethoxy-10-(4-methoxyphenyl)-11-phenyl-9-oxa-14,19-diazapentacyclo[10.7.0.0²,¹⁰.0³,⁸.0¹⁴,¹⁸]nonadeca-1(12),3,5,7,18-pentaen-13-one
4- coffee acid
{"Ingredient_id": "HBIN010300","Ingredient_name": "4- coffee acid","Alias": "NA","Ingredient_formula": "C25H28N6O7","Ingredient_Smile": "CN1C=NC2C1C(=O)N(C(=O)N2C)C.C[N+]1=CC=CC(=C1)C(=O)[O-].C1=COC=C1.C1=CC(=CN=C1)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34446","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6'-o-e-p-methoxycinnamoylharpagide
{"Ingredient_id": "HBIN012675","Ingredient_name": "6'-o-e-p-methoxycinnamoylharpagide","Alias": "NA","Ingredient_formula": "C25H32O12","Ingredient_Smile": "CC1(CC(C2(C1C(OC=C2)OC3C(C(C(C(O3)COC(=O)C=CC4=CC=C(C=C4)OC)O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13881","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6-o-z-feruloylajugol
{"Ingredient_id": "HBIN012742","Ingredient_name": "6-o-z-feruloylajugol","Alias": "NA","Ingredient_formula": "C25H32O12","Ingredient_Smile": "CC1(CC(C2C1C(OC=C2)OC3C(C(C(C(O3)CO)O)O)O)OC(=O)C=CC4=CC(=C(C=C4)O)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7769","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6'-o-z-p-methoxycinnamoylharpagide
{"Ingredient_id": "HBIN012744","Ingredient_name": "6'-o-z-p-methoxycinnamoylharpagide","Alias": "NA","Ingredient_formula": "C25H32O12","Ingredient_Smile": "CC1(CC(C2(C1C(OC=C2)OC3C(C(C(C(O3)COC(=O)C=CC4=CC=C(C=C4)OC)O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13882","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(8 e)-ligustroside
{"Ingredient_id": "HBIN013712","Ingredient_name": "(8 e)-ligustroside","Alias": "NA","Ingredient_formula": "C25H32O12","Ingredient_Smile": "CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OCCC3=CC=C(C=C3)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "12822","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
8-o-e-p-methoxycinnamoylharpagide
{"Ingredient_id": "HBIN013855","Ingredient_name": "8-o-e-p-methoxycinnamoylharpagide","Alias": "NA","Ingredient_formula": "C25H32O12","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13883","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
8-(o-methyl-p-coumaroyl)harpaside
{"Ingredient_id": "HBIN013864","Ingredient_name": "8-(o-methyl-p-coumaroyl)harpaside","Alias": "NA","Ingredient_formula": "C25H32O12","Ingredient_Smile": "CC1(CC(C2(C1C(OC=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O)OC(=O)C=CC4=CC=C(C=C4)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "25495","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
8-o-z-p-methoxycinnamoylharpagide
{"Ingredient_id": "HBIN013876","Ingredient_name": "8-o-z-p-methoxycinnamoylharpagide","Alias": "NA","Ingredient_formula": "C25H32O12","Ingredient_Smile": "CC1(CC(C2(C1C(OC=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O)OC(=O)C=CC4=CC=C(C=C4)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13884","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(8z)-ligustroside
{"Ingredient_id": "HBIN013910","Ingredient_name": "(8z)-ligustroside","Alias": "NA","Ingredient_formula": "C25H32O12","Ingredient_Smile": "CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OCCC3=CC=C(C=C3)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "12823","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
ajugol; 6-o-(4-hydroxy-3-methoxy-e-cinnamoyl)
{"Ingredient_id": "HBIN014993","Ingredient_name": "ajugol; 6-o-(4-hydroxy-3-methoxy-e-cinnamoyl)","Alias": "NA","Ingredient_formula": "C25H32O12","Ingredient_Smile": "NA","Ingredient_weight": "524.51","OB_score": "NA","CAS_id": "124168-06-5","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7090","PubChem_id": "NA","DrugBank_id": "NA"}
ajugol; 6-o-(4-hydroxy-3-methoxy-z-cinnamoyl)
{"Ingredient_id": "HBIN014994","Ingredient_name": "ajugol; 6-o-(4-hydroxy-3-methoxy-z-cinnamoyl)","Alias": "NA","Ingredient_formula": "C25H32O12","Ingredient_Smile": "NA","Ingredient_weight": "524.51","OB_score": "NA","CAS_id": "124224-02-8","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7089","PubChem_id": "NA","DrugBank_id": "NA"}