Exact Mass: 606.1868
Exact Mass Matches: 606.1868
Found 215 metabolites which its exact mass value is equals to given mass value 606.1868
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Bruceantinol
Bruceantinol is a triterpenoid. Bruceantinol is a natural product found in Brucea javanica with data available.
6'-Acetylapiin
6-Acetylapiin is found in herbs and spices. 6-Acetylapiin is a constituent of parsley Constituent of parsley. 6-Acetylapiin is found in herbs and spices.
Aurasperone B
Aurasperone B is a mycotoxin from Aspergillus niger, Aspergillus awamori and Aspergillus fonsecaeu
6'-O-Acetylvicenin 1
6-O-Acetylvicenin 1 is found in green vegetables. 6-O-Acetylvicenin 1 is a constituent of Prosopis chilensis (algarrobo blanco). Constituent of Prosopis chilensis (algarrobo blanco). 6-O-Acetylvicenin 1 is found in green vegetables.
1,5-Bis(4'-glucopyranosyloxy-3'-hydroxyphenyl)pent-4-en-1-yne
Asp-Asp-Asp-Asp-Lys
Sulforhodamine 101
Pinocembrin 7-O-neohesperidoside 6-O-acetate
Kaempferol 3-(3-acetyl-alpha-L-arabinofuranoside)-7-rhamnoside
Pinocembrin 7-O-neohesperidoside 3-O-acetate
4,2,3,4-Tetrahydroxychalcone 4-O-(2-O-acetyl-6-O-cinnamoyl)glucoside
Skullcapflavone I 2-(2-E-cinnamoylglucoside)
Skullcapflavone I 2-(4-E-Cinnamoylglucoside)
Vicenin-1 6-O-acetate
3-(1,3-benzodioxol-5-yl)-7-[(2S,3R,4S,5S,6R)-6-[[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-methoxychromen-4-one
skullcapflavone I 2-O-beta-D-(3-E-cinnamoyl)glucopyranoside|SkullcapflavoneI 2-O-??-D-(3-E-cinnamoyl)glucopyranoside
7-O-(alpha-L-Rhamnosyl-beta-D-galacturonoside)-Acacetien
1-Methoxy-3-hydroxy-2-carbomethoxy-9,10-anthraquinone 3-O-??-primeveroside
(3E,5E,7R,84S)-12c-acetoxy-14-chloro-10t,11c-epoxy-84-hydroxy-15,7r-dimethoxy-3,9c,11t,15-tetramethyl-(84rH,86cH)-15-aza-1(1,3)-benzena-8(4,6)-[1,3]oxazinana-cyclopentadecaphane-3,5-diene-82,14-dione|ansamitocin P1|C-15003 P-1,Maytanacin|Maytanacin (6)|Maytanacine|O3-acetyl-maytansinol
2-Methyl-1,3,6-trihydroxy-9,10-anthraqui-none-3-O-??-D-xylosyl-(1鈥樏傗垎2)-??-D-(6-O-acetyl) glucoside|Methyl (24E)-3??,9,23-trihydroxy-17,14-friedo-lanostan-14,24-dien-26-oate
6-Methoxy-3,4-(methylene(2-methyl-6-methoxy-1,2,3,4-tetrahydroisoquinoline-1,7-diyl)oxy(1-oxo-2-methyl-5,6-(epoxymethanoxy)-1,2-dihydro-3H-isoindole-4,3-diyl)methylene)(1,1-oxybisbenzene)
oxytroflavoside D|rhamnocitrin-3-O-[(S)-3-hydroxy-3-methylglutaryl-(1->6)]-beta-D-galactopyranoside
chrysoeriol-7-O-alpha-L-rhamnosyl-(1->6)-beta-D-glucoside|chrysoeriol-7-O-rutinoside
(E)-1,5-bis(4-beta-D-glucopyranosyloxy-3-hydroxyphenyl)pent-4-en-1-yne|(E)-1,5-bis-(4-beta-D-glucopyranosyloxy-3-hydroxyphenyl)pent-1-en-4-yne|hypoxoside
cissoside I|kaempferol 3-O-alpha-L-(5-O-acetyl)-arabinofuranosyl-7-O-alpha-L-rhamnopyranoside
Hepta-O-acetyl-beta-primverose|Primeverose-heptaacetat
1alpha,2alpha,6beta,13-tetraacetoxy-9alpha-benzoyloxy-4beta,6beta-dihydroxy-beta-dihydroagarofuran|ejaponine B
kaempferol 3-O-(5-O-acetyl-alpha-D-apiofuranosyl)-7-O-alpha-L-rhamnopyranoside|kaempferol 3-O-(5-O-acetylapiosyl)-7-O-rhamnopyranosyl
3-(1,3-benzodioxol-5-yl)-7-[(2S,3R,4S,5S,6R)-6-[[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-methoxychromen-4-one
Biflavonoid-flavone base + 3O and flavone base + 3O + 1Prenyl
Annotation level-3
Asp Phe Tyr Tyr
Asp Tyr Phe Tyr
Asp Tyr Tyr Phe
Phe Asp Tyr Tyr
Phe Tyr Asp Tyr
Phe Tyr Tyr Asp
Met Met Tyr Tyr
Met Tyr Met Tyr
Met Tyr Tyr Met
Tyr Asp Phe Tyr
Tyr Asp Tyr Phe
Tyr Phe Asp Tyr
Tyr Phe Tyr Asp
Tyr Met Met Tyr
Tyr Met Tyr Met
Tyr Tyr Asp Phe
Tyr Tyr Phe Asp
Tyr Tyr Met Met
Aurasperone B
A dimeric naphthopyran with formula C32H30O12, isolated from several Aspergillus species.
6''-Acetylapiin
6''-O-Acetylvicenin 1
AI3-22370
D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010277 - Parasympathomimetics D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D004791 - Enzyme Inhibitors
Protoporphyrin disodium
D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents C26170 - Protective Agent > C2081 - Hepatoprotective Agent D003879 - Dermatologic Agents
2-[(1E,3E)-5-(3,3-DIMETHYL-1-PHENYL-1,3-DIHYDRO-2H-INDOL-2-YLIDENE)-1,3-PENTADIENYL]-3,3-DIMETHYL-1-PHENYL-3H-INDOLIUM PERCHLORATE
Sulforhodamine 101
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D012235 - Rhodamines D004396 - Coloring Agents
(((9H-FLUORENE-9,9-DIYL)BIS(4,1-PHENYLENE))BIS(OXY))BIS(2-HYDROXYPROPANE-3,1-DIYL) DIACRYLATE
1,3,6-trihydroxy-2-methyl-9,10-anthraquinone-3-O-(6-O-acetyl)-beta-D-xylopyranosyl-(1->2)-beta-D-glucopyranoside
A disaccharide derivative that is 1,3,6-trihydroxy-2-methyl-9,10-anthraquinone attached to a (6-O-acetyl)-beta-D-xylopyranosyl-(1->2)-beta-D-glucopyranosyl residue at position 3 via a glycosidic linkage. It has been isolated from the roots of Rubia yunnanensis.
6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-5-hydroxy-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
alpha-D-xylopyranosyl-(1->6)-[alpha-D-xylopyranosyl-(1->6)-beta-D-glucopyranosyl-(->4)]-beta-D-glucopyranose
magnesium;(E)-3-[11,16-bis(ethenyl)-3-methoxycarbonyl-12,17,21,26-tetramethyl-4-oxido-23,25-diaza-7,24-diazanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,3,5,8(26),9,11,13(25),14,16,18,20(23),21-dodecaen-22-yl]prop-2-enoate
2-[2-hydroxy-4-[(E)-5-[3-hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]pent-1-en-4-ynyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
citrifolinoside
An unusual iridoid monoterpenoid isolated from the leaves of Morinda citrifolia. It exhibits significant inhibition of UVB-induced Activator Protein-1 (AP-1) activity in cell cultures.
kaempferol 3-O-(5-O-acetyl-alpha-D-apiofuranosyl)-7-O-alpha-L-rhamnopyranoside
A glycosyloxyflavone that is kaempferol attached to a 5-O-acetyl-alpha-D-apiofuranosyl residue at position 3 and a alpha-L-rhamnopyranosyl residue at position 7 via glycosidic linkages. Isolated from the aerial parts of Vicia faba and Lotus edulis, it exhibits inhibitory activity against topoisomerse I and II.
10-(2,5-dihydroxy-6,8-dimethoxy-2-methyl-4-oxo-3H-benzo[g]chromen-10-yl)-2,5-dihydroxy-6,8-dimethoxy-2-methyl-3H-benzo[g]chromen-4-one
4-(2,3,6,7,12,13,16,17-octahydro-1H,5H,11H,15H-pyrido[3,2,1-ij]quinolizino[1,9:6,7,8]chromeno[2,3-f]quinolin-18-ium-9-yl)-3-sulfobenzenesulfonate
6-[(3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-5-hydroxy-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
(1S)-N-(4-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-(3-methylphenyl)sulfonyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,4-piperidine]carboxamide
(1R)-N-(4-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-(3-methylphenyl)sulfonyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,4-piperidine]carboxamide
1-[(2R,3S)-2-[[(4-chlorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-cyclohexylurea
3-[18-(2-carboxylatoethyl)-3,7,7,8,12,13,17-heptamethyl-8H-porphyrin-21,23-diid-2-yl]propanoate;iron
(2S,3R,4S,5R,6R)-6-[[(3R,5R,8S,9S,10S,13S,14S,17R)-17-carboxy-17-hydroxy-10,13-dimethyl-11-oxo-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,5-dihydroxy-4-sulfooxyoxane-2-carboxylic acid
iron methylchlorin(2-)
A dicarboxylic acid dianion resulting from the removal of a proton from both of the carboxy groups of iron methylchlorin. Major species at pH 7.3.
A-317491 (sodium salt hydrate)
A-317491 sodium salt hydrate is a potent, selective and non-nucleotide antagonist of P2X3 and P2X2/3 receptors, with Kis of 22, 22, 9, and 92 nM for hP2X3, rP2X3, hP2X2/3, and rP2X2/3, respectively. A-317491 sodium salt hydrate is highly selective (IC50>10 μM) over other P2 receptors and other neurotransmitter receptors, ion channels, and enzymes. A-317491 sodium salt hydrate reduces inflammatory and neuropathic pain by blocking P2X3 and P2X2/3 receptor-mediated calcium flux[1][2].
1-(3-chloro-2,4-dimethoxy-6-methylphenyl)-8,10,12-trihydroxy-3-methoxy-6,6-dimethyl-5a-(2-oxopropyl)tetracene-5,11-dione
6-[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]-5-hydroxy-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
(1r,2s,4s,5s,13s)-14'-hydroxy-8,10',15'-trimethoxy-14-methyl-6,12'-dioxa-4',14-diazaspiro[pentacyclo[9.5.1.0¹,⁵.0²,¹³.0⁷,¹⁷]heptadecane-4,3'-pentacyclo[9.7.2.0⁴,¹⁹.0⁷,²⁰.0¹³,¹⁸]icosane]-1'(19'),7(17),7'(20'),8,8',10,10',13',15',17'-decaen-2'-one
(1s,2s,4s,5r,6s,7s,8s,9s,12r)-4,5,8-tris(acetyloxy)-6-[(acetyloxy)methyl]-2,12-dihydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate
4-methoxy-3-[4-({11-methoxy-6,19-dimethyl-20-oxo-2,13-dioxa-6,19-diazapentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁶,²¹]docosa-1(22),3(12),4(9),10,14,16(21)-hexaen-5-yl}methyl)phenoxy]benzaldehyde
{3,4-dihydroxy-6-[(5-hydroxy-4-oxo-2-phenyl-2,3-dihydro-1-benzopyran-7-yl)oxy]-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}methyl acetate
6-[(2r,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]-5-hydroxy-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
2-({4,5-dihydroxy-2-[(5-hydroxy-4-oxo-2-phenyl-2,3-dihydro-1-benzopyran-7-yl)oxy]-6-(hydroxymethyl)oxan-3-yl}oxy)-3,5-dihydroxy-6-methyloxan-4-yl acetate
7-methoxy-3-(4-methoxyphenyl)-8-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]chromen-4-one
1',7'-dimethyl 8'-chloro-6'-heptyl-3',5-dihydroxy-9'-methoxy-7-methyl-4-oxo-4'-oxaspiro[1,3-benzodioxine-2,2'-tricyclo[5.3.1.0³,⁸]undecane]-5',9'-diene-1',7'-dicarboxylate
(13s)-5-hydroxy-19,20,24-trimethoxy-14-methyl-7,22-dioxa-14,29-diazaheptacyclo[21.6.3.2⁸,¹¹.1²,⁶.1¹³,¹⁷.0²⁶,³¹.0²¹,³³]hexatriaconta-1(29),2,4,6(36),8,10,17(33),18,20,23(32),24,26(31),34-tridecaen-30-one
4,5-dihydroxy-6-[2-(5-hydroxy-7,8-dimethoxy-4-oxochromen-2-yl)phenoxy]-2-(hydroxymethyl)oxan-3-yl 3-phenylprop-2-enoate
1',7'-dimethyl (1's,2r,3'r,7'r,8'r)-8'-chloro-6'-heptyl-3',5-dihydroxy-9'-methoxy-7-methyl-4-oxo-4'-oxaspiro[1,3-benzodioxine-2,2'-tricyclo[5.3.1.0³,⁸]undecane]-5',9'-diene-1',7'-dicarboxylate
(2s,3r,4r,5r,6s)-2-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-2-{[(2s)-5-hydroxy-4-oxo-2-phenyl-2,3-dihydro-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxan-3-yl]oxy}-4,5-dihydroxy-6-methyloxan-3-yl acetate
methyl 3-{[4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-10,15,16-trihydroxy-9,13-dimethyl-4,11-dioxo-5,18-dioxapentacyclo[12.5.0.0¹,⁶.0²,¹⁷.0⁸,¹³]nonadec-9-ene-17-carboxylate
9-hydroxy-20,21,25-trimethoxy-30-methyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.2³,⁶.1⁸,¹².1¹⁴,¹⁸.0²⁷,³¹.0²²,³³]hexatriaconta-3,5,8(34),9,11,14,18(33),19,21,24(32),25,27(31),35-tridecaen-13-one
methyl 11,16,18,23-tetrahydroxy-7-(1-hydroxy-4-methoxy-4-oxobutyl)-20-methyl-9,14-dioxo-6-oxahexacyclo[11.10.2.0¹,¹⁵.0³,¹².0⁵,¹⁰.0¹⁷,²²]pentacosa-3,5(10),11,15,17,19,21,24-octaene-7-carboxylate
(2r,3s,4r,5r,6s)-4,5-dihydroxy-2-[2-(5-hydroxy-7,8-dimethoxy-4-oxochromen-2-yl)phenoxy]-6-(hydroxymethyl)oxan-3-yl (2e)-3-phenylprop-2-enoate
(4s)-1-[(4as,5r,6s)-5-ethenyl-1-oxo-6-{[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,4h,4ah,5h,6h-pyrano[3,4-c]pyran-3-yl]-4-hydroxy-8-(4-hydroxyphenyl)octane-2,6-dione
[(2r,3s,4s,5r,6s)-3,4-dihydroxy-6-{[(2s)-5-hydroxy-4-oxo-2-phenyl-2,3-dihydro-1-benzopyran-7-yl]oxy}-5-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]methyl acetate
2-[(2-{[(2,3-dihydroxyphenyl)(hydroxy)methylidene]amino}-1-hydroxyethylidene)amino]-3-({2-[(2-{[(2,3-dihydroxyphenyl)(hydroxy)methylidene]amino}-1-hydroxyethylidene)amino]-3-hydroxybutanoyl}oxy)butanoic acid
6-methoxy-3-(4-methoxyphenyl)-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}chromen-4-one
1-methoxy-3-hydroxy-2-carbomethoxy-9,10-anthraquinone
{"Ingredient_id": "HBIN002700","Ingredient_name": "1-methoxy-3-hydroxy-2-carbomethoxy-9,10-anthraquinone","Alias": "NA","Ingredient_formula": "C28H30O15","Ingredient_Smile": "COC1=C2C(=CC(=C1C(=O)OC)OC3C(C(C(C(O3)COC4C(C(C(CO4)O)O)O)O)O)O)C(=O)C5=CC=CC=C5C2=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13945","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1-methoxy-3-hydroxy-2-carbomethoxy-9,10-anthraquinone 3-o-β-primeveroside
{"Ingredient_id": "HBIN002701","Ingredient_name": "1-methoxy-3-hydroxy-2-carbomethoxy-9,10-anthraquinone 3-o-\u03b2-primeveroside","Alias": "NA","Ingredient_formula": "C28H30O15","Ingredient_Smile": "COC1=C2C(=CC(=C1C(=O)OC)OC3C(C(C(C(O3)COC4C(C(C(CO4)O)O)O)O)O)O)C(=O)C5=CC=CC=C5C2=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13946","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-methyl-1,3,6-trihydroxy-9,10-anthraqui-none-3-o-beta-d-xylosyl-(1-2)-beta-d-(6'-o-acetyl)glucoside
{"Ingredient_id": "HBIN005938","Ingredient_name": "2-methyl-1,3,6-trihydroxy-9,10-anthraqui-none-3-o-beta-d-xylosyl-(1-2)-beta-d-(6'-o-acetyl)glucoside","Alias": "NA","Ingredient_formula": "C28H30O15","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31689","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-methyl-1,3,6-trihydroxy-9,10-anthraquinone-3-o-β-d-xylosyl-(1→2)-β-d-(6'-o-acetyl)glucoside
{"Ingredient_id": "HBIN005939","Ingredient_name": "2-methyl-1,3,6-trihydroxy-9,10-anthraquinone-3-o-\u03b2-d-xylosyl-(1\u21922)-\u03b2-d-(6'-o-acetyl)glucoside","Alias": "NA","Ingredient_formula": "C28H30O15","Ingredient_Smile": "COC1=C2C(=CC(=C1C(=O)OC)OC3C(C(C(C(O3)COC4C(C(C(CO4)O)O)O)O)O)O)C(=O)C5=CC=CC=C5C2=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14771","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-o-methylellagicacid3'-(3''-o-acetyl)-α-rhamnoside
{"Ingredient_id": "HBIN010779","Ingredient_name": "4-o-methylellagicacid3'-(3''-o-acetyl)-\u03b1-rhamnoside","Alias": "NA","Ingredient_formula": "C28H30O15","Ingredient_Smile": "CC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)OC4C(C(C(O4)CO)OC(=O)C)O)C5=CC=C(C=C5)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14333","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6,8-dihexosyl-4',5-dihydroxy-7-methoxyflavone
{"Ingredient_id": "HBIN012117","Ingredient_name": "6,8-dihexosyl-4',5-dihydroxy-7-methoxyflavone","Alias": "NA","Ingredient_formula": "C28H30O15","Ingredient_Smile": "NA","Ingredient_weight": "606.536","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7606","PubChem_id": "NA","DrugBank_id": "NA"}