Exact Mass: 644.2469
Exact Mass Matches: 644.2469
Found 170 metabolites which its exact mass value is equals to given mass value 644.2469
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Reserpine HCl
Reserpine hydrochloride is an inhibitor of the vesicular monoamine transporter 2 (VMAT2). Reserpine hydrochloride is an inhibitor of the vesicular monoamine transporter 2 (VMAT2).
Lapaquistat acetate
kaempferide 3-glucoside-7-rhamnoside
4-O-Methylneobavaisoflavone 7-O-(2-p-coumaroylglucoside)
Me glycoside,2,3-dibenzoyl,tri-Ac-alpha-Pyranose-4-O-alpha-L-Rhamnopyranosyl-D-xylose
Me glycoside,4,6-O-benzylidene,3-benzyl,2,3,4-tri-Ac-Pyranose-2-O-alpha-L-Rhamnopyranosyl-D-galactose
Me glycoside,4,6-O-benzylidene,2-benzyl,2,3,4-tri-Ac-beta-Pyranose-3-O-alpha-L-Rhamnopyranosyl-D-galactose
Taccalonolide E
Taccalonolide E is a natural product found in Tacca plantaginea and Tacca chantrieri with data available.
2-[[2-(1,3-dicarboxypropyl)-6,6,9a-trimethyl-5-[(2E,4E,6E)-octa-2,4,6-trienoyl]oxy-1-oxo-4,5,5a,7,8,9-hexahydro-3H-benzo[e]isoindol-4-yl]amino]pentanedioic acid
His Tyr Tyr Tyr
Asn Trp Tyr Tyr
Asn Tyr Trp Tyr
Asn Tyr Tyr Trp
Trp Asn Tyr Tyr
Trp Tyr Asn Tyr
Trp Tyr Tyr Asn
Tyr His Tyr Tyr
Tyr Asn Trp Tyr
Tyr Asn Tyr Trp
Tyr Trp Asn Tyr
Tyr Trp Tyr Asn
Tyr Tyr His Tyr
Tyr Tyr Asn Trp
Tyr Tyr Trp Asn
Tyr Tyr Tyr His
(r)-(+)-2,2,6,6-tetramethoxy-4,4-bis(diphenylphosphino)-3,3-bipyridine
3,5-BIS(TERT-BUTYLDIPHENYLSILYLOXY)BENZOIC ACID METHYL ESTER
2-((1E,3E)-3-(3-butyl-1,1-dimethyl-1H-benzo[e]indol-2(3H)-ylidene)prop-1-enyl)-1,1,3-trimethyl-1H-benzo[e]indolium
5-O-(4,4-Dimethoxytrityl)-thymidine-3-O-succinic acid
Lapaquistat Acetate
C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent
(S)-7,7-Bis[di(p-methylphenyl)phosphino]-1,1-spirobiindane
1,1-[(phenylmethylene)bis[(2-methoxy-4,1-phenylene)azo]]bis(2-naphthol)
4-[5-(cyclopropanecarbonylamino)-2-(trifluoromethoxy)phenyl]-N-[4-[(4-propylsulfonylpiperazin-1-yl)methyl]phenyl]benzamide
Nazartinib mesylate trihydrate
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C163952 - EGFR-targeting Agent C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor D000970 - Antineoplastic Agents
Rabacfosadine Succinate
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor
[(2R,3R,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-4-hydroxy-2-[[[[(1S)-2-isopropoxy-1-methyl-2-oxo-ethyl]amino]-phenoxy-phosphoryl]oxymethyl]-4-methyl-tetrahydrofuran-3-yl] 2-methylpropanoate
iron(4+);methyl 3-[(1Z,4Z,10Z,14Z)-7,12-bis(ethenyl)-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethylporphyrin-21,22,23,24-tetraid-2-yl]propanoate
kaempferide 3-glucoside-7-rhamnoside
12-Ethyl-71-hydroxy-8-isobutylbacteriochlorophyllide c
1-[1-carboxy-3-[[3-carboxy-5-[3-[[(E)-dec-2-enoyl]-hydroxyamino]propylamino]-3-hydroxy-5-oxopentanoyl]amino]propyl]-2-hydroxy-5-oxopyrrolidine-2-carboxylic acid
[(2R,3S,4R,5S)-5-[(2R,3S,4S)-5-[4-[[(1R)-1-[(7S)-2-amino-7-methyl-4-oxo-7,8-dihydro-3H-pteridin-6-yl]ethyl]amino]phenyl]-2,3,4-trihydroxypentoxy]-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
(-)-(7R,7R,7S,8S,8S,8S)-4,4-dihydroxy-3,3,3,5,5,5-hexamethoxy-7,9:7,9-diepoxy-4,8-oxy-8,8-sesquineolignan-7,9-diol
A neolignan isolated from the stems of Sinocalamus affinis.
(-)-(7R,7R,7R,8S,8S,8S)-4,4-dihydroxy-3,3,3,5,5,5-hexamethoxy-7,9:7,9-diepoxy-4,8-oxy-8,8-sesquineolignan-7,9-diol
A neolignan isolated from Sinocalamus affinis.
N-[(3R,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-thiophenesulfonamide
N-[(3R,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-thiophenesulfonamide
(1S,16R)-21-hydroxy-10,25-dimethoxy-15,15,30-trimethyl-7,23-dioxa-30-aza-15-azoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaen-9-olate;hydrochloride
[2-hydroxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropyl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
2-[[2-(1,3-dicarboxypropyl)-6,6,9a-trimethyl-5-[(2E,4E,6E)-octa-2,4,6-trienoyl]oxy-1-oxo-4,5,5a,7,8,9-hexahydro-3H-benzo[e]isoindol-4-yl]amino]pentanedioic acid
(1S)-21-hydroxy-10,25-dimethoxy-15,15,30-trimethyl-7,23-dioxa-30-aza-15-azoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaen-9-olate;hydrochloride
1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycero-3-phospho-(1-myo-inositol)
n-[(2r)-1-[(1r,12r,13s,14r,15s)-1,15-dihydroxy-3-methoxy-12-(4-methoxyphenyl)-13-phenyl-5,7,11-trioxatetracyclo[10.2.1.0²,¹⁰.0⁴,⁸]pentadeca-2,4(8),9-triene-14-carbonyl]pyrrolidin-2-yl]-3-methylbutanimidic acid
20,21-bis(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
methyl 2-[(1r,3s,4s,5r,7r,8s,10s,11r,12r,13r)-4,5,11-tris(acetyloxy)-13-(furan-3-yl)-6,6,8,12-tetramethyl-17-methylidene-9,15-dioxo-2,14-dioxatetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan-7-yl]acetate
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-methoxy-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]benzoate
(13s,14e,15s)-14-ethylidene-4,22-dihydroxy-15-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,10,16,20-tetraoxatetracyclo[21.2.2.1³,⁷.0¹³,¹⁸]octacosa-1(25),3(28),4,6,17,23,26-heptaene-11,19-dione
(1s,2r,4r,5r,6s,8r,10s,11s,12r,14r,15r,16r,19s,21r)-4,21-bis(acetyloxy)-6-(furan-3-yl)-12,19-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0⁸,¹⁰]henicosan-16-yl 2-methylpropanoate
(8r,9s,10r,11r)-3,4,5,19-tetramethoxy-9,10-dimethyl-8-{[(2e)-3-phenylprop-2-enoyl]oxy}-15,17-dioxatetracyclo[10.7.0.0²,⁷.0¹⁴,¹⁸]nonadeca-1(19),2(7),3,5,12,14(18)-hexaen-11-yl (2z)-2-methylbut-2-enoate
(2r)-n-[(2r)-1-[(1r,12r,13s,14r,15s)-1,15-dihydroxy-3-methoxy-12-(4-methoxyphenyl)-13-phenyl-5,7,11-trioxatetracyclo[10.2.1.0²,¹⁰.0⁴,⁸]pentadeca-2,4(8),9-triene-14-carbonyl]pyrrolidin-2-yl]-2-methylbutanimidic acid
(13s,14e,15s,22r)-14-ethylidene-4,22-dihydroxy-15-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,10,16,20-tetraoxatetracyclo[21.2.2.1³,⁷.0¹³,¹⁸]octacosa-1(25),3(28),4,6,17,23,26-heptaene-11,19-dione
n-[(2r)-1-[(1r,12r,13s,14r,15r)-1,15-dihydroxy-3-methoxy-12-(4-methoxyphenyl)-14-phenyl-5,7,11-trioxatetracyclo[10.2.1.0²,¹⁰.0⁴,⁸]pentadeca-2,4(8),9-triene-13-carbonyl]pyrrolidin-2-yl]-3-methylbutanimidic acid
methyl 2-[(1r,3r,4r,5s,7s,8r,10r,12s,13s)-4,5,10-tris(acetyloxy)-13-(furan-3-yl)-6,6,8,12-tetramethyl-17-methylidene-9,15-dioxo-2,14-dioxatetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan-7-yl]acetate
n-{1-[(12r,13s,14r)-1,15-dihydroxy-3-methoxy-12-(4-methoxyphenyl)-14-phenyl-5,7,11-trioxatetracyclo[10.2.1.0²,¹⁰.0⁴,⁸]pentadeca-2,4(8),9-triene-13-carbonyl]pyrrolidin-2-yl}-3-methylbutanimidic acid
(1s,2r,3r,5s,7s,9s,10r,11r,12s,14s,15r,16s,17s,22s,23s,24s,25r)-14,25-bis(acetyloxy)-3,22-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl acetate
12- o -acetylazedarachin b
{"Ingredient_id": "HBIN000914","Ingredient_name": "12- o -acetylazedarachin b","Alias": "NA","Ingredient_formula": "C34H44O12","Ingredient_Smile": "CC(C)C(=O)OC1C2(C3CC(C4(C(C3(CO1)C(CC2OC(=O)C)O)C(=O)C(C5(C46C(O6)CC5C7=COC=C7)C)OC(=O)C)C)O)C","Ingredient_weight": "644.71","OB_score": "NA","CAS_id": "163634-39-7","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9376","PubChem_id": "101930513","DrugBank_id": "NA"}
3'-prenyl-4'-methoxy-isoflavone-7-o'-β-d-(2''-o-p-coumaroyl)glycopyranoside
{"Ingredient_id": "HBIN009478","Ingredient_name": "3'-prenyl-4'-methoxy-isoflavone-7-o'-\u03b2-d-(2''-o-p-coumaroyl)glycopyranoside","Alias": "NA","Ingredient_formula": "C36H36O11","Ingredient_Smile": "CC(=CCC1=C(C=CC(=C1)C2=COC3=C(C2=O)C=CC(=C3)OC4C(C(C(C(O4)CO)O)O)OC(=O)C=CC5=CC=C(C=C5)O)OC)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "17824","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6-o-(4''-o-α-l-rhamnopyranosyl)vanilloyl-ajugol
{"Ingredient_id": "HBIN012586","Ingredient_name": "6-o-(4''-o-\u03b1-l-rhamnopyranosyl)vanilloyl-ajugol","Alias": "NA","Ingredient_formula": "C29H40O16","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "18720","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6-o-(4''-o-alpha-l-rhamnopyranpsyl)vanilloylajugol
{"Ingredient_id": "HBIN012587","Ingredient_name": "6-o-(4''-o-alpha-l-rhamnopyranpsyl)vanilloylajugol","Alias": "NA","Ingredient_formula": "C29H40O16","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31909","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
ajugol; 6-o-[3-methoxy-4-(alpha-l-rhamnopyranosyloxy)benzoyl]
{"Ingredient_id": "HBIN014991","Ingredient_name": "ajugol; 6-o-[3-methoxy-4-(alpha-l-rhamnopyranosyloxy)benzoyl]","Alias": "NA","Ingredient_formula": "C29H40O16","Ingredient_Smile": "NA","Ingredient_weight": "644.62","OB_score": "NA","CAS_id": "124168-07-6","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7086","PubChem_id": "NA","DrugBank_id": "NA"}
(±)-Bbuddlenol D
{"Ingredient_id": "HBIN017655","Ingredient_name": "(±)-Bbuddlenol D","Alias": "NA","Ingredient_formula": "C33H40O13","Ingredient_Smile": "COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)OC(CO)C(C5=CC(=C(C(=C5)OC)O)OC)O)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34050","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}