Human Metabolome Database: Browsing metabolites

HMDB ID CAS Number	Name	Formula Average Mass Monoisotopic Mass	Biospecimen Location
HMDB0240205 380843-75-4	Bosutinib	C₂₆H₂₉Cl₂N₅O₃ 530.446 529.164745233
HMDB0062475	β-L-IdoA2S-(1→4)-α-D-GlcNAc3S-(1→4)-β-D-GlcA(1→3)-β-D-Gal(1→3)-β-D-Gal(1→4)-D-Xyl	C₃₇H₅₉NO₃₈S₂ 1189.97 1189.215648812
HMDB0062495	β-L-IdoA-(1→4)-α-D-GlcNAc3S-(1→4)-β-D-GlcA(1→3)-β-D-Gal(1→3)-β-D-Gal(1→4)-D-Xyl	C₃₇H₅₉NO₃₅S 1109.91 1109.258833778
HMDB0062476	α-D-GlcNAc3S-(1→4)-β-D-GlcA(1→3)-β-D-Gal(1→3)-β-D-Gal(1→4)-D-Xyl	C₃₁H₅₁NO₂₉S 933.79 933.2267458
HMDB0240575	Α-chaconine	C₄₅H₇₃NO₁₄ 852.0594 851.503106049	Blood Urine
HMDB0304547	œâ-hydroxylaurate	C₁₂H₂₃O₃ 215.314 215.165268181
HMDB0243768	{[5-(5-Nitro-2-furyl)-1,3,4-oxadiazol-2-YL]thio}acetic acid	C₈H₅N₃O₆S 271.207 270.989905597	Blood
HMDB0248788	{4-[4-(6-Carbamoyl-3,5-dimethylpyrazin-2-yl)phenyl]cyclohexyl}acetic acid	C₂₁H₂₅N₃O₃ 367.449 367.189591677	Blood
HMDB0257352	{4-[2-Acetylamino-2-(1-biphenyl-4-ylmethyl-2-oxo-azepan-3-ylcarbamoyl)-ethyl]-2-phosphono-phenoxy}-acetic acid	C₃₂H₃₆N₃O₉P 637.626 637.218916749	Blood
HMDB0252987	{4-[({2-[3-Fluoro-4-(Trifluoromethyl)phenyl]-4-Methyl-1,3-Thiazol-5-Yl}methyl)sulfanyl]-2-Methylphenoxy}acetic Acid	C₂₁H₁₇F₄NO₃S₂ 471.488 471.058597615	Blood
HMDB0253771	{3,5-Dichloro-4-[4-Hydroxy-3-(Propan-2-Yl)phenoxy]phenyl}acetic Acid	C₁₇H₁₆Cl₂O₄ 355.213 354.042564414	Blood
HMDB0127769	{2-methoxy-4-[(5-oxooxolan-2-yl)methyl]phenyl}oxidanesulfonic acid	C₁₂H₁₄O₇S 302.3 302.046023965	Blood Urine
HMDB0124760	{2,6-dihydroxy-4-[4-hydroxy-7-(hydroxymethyl)-11-oxo-2,8-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),3,5(13),6,9-pentaen-3-yl]phenoxy}dihydroxyoxo-λ⁶-sulfanylium	C₁₈H₁₂O₁₁S 436.34 436.01003238
HMDB0257277	{1-[2-(4-Carbamimidoyl-benzoylamino)-propionyl]-piperidin-4-yloxy}-acetic acid	C₁₈H₂₄N₄O₅ 376.413 376.174669889	Blood
HMDB0247872	[[(3R,4R,5S,6R)-3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]amino] N-phenylcarbamate	C₁₅H₂₁N₃O₇ 355.347 355.137950028	Blood
HMDB0258116	[[(2S,5S)-5-(2,4-Dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate	C₉H₁₅N₂O₁₅P₃ 484.139 483.968528785	Blood
HMDB0247873	[[(2S,3R,4R,5R)-5-(2-Amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate	C₁₀H₁₆N₅O₁₄P₃ 523.18 522.990661209	Blood
HMDB0258095	[[(2R,5R)-5-(6-Aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate	C₁₀H₁₆N₅O₁₂P₃ 491.182 491.000831969	Blood
HMDB0257997	[[(2R,5R)-5-(6-Aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate	C₁₀H₁₆N₅O₁₃P₃ 507.181 506.995745159	Blood
HMDB0257689	[[(2R,5R)-3,4-Dihydroxy-5-(6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate	C₁₀H₁₅N₄O₁₄P₃ 508.165 507.979762173	Blood
HMDB0029807 6419-19-8	[Nitrilotris(methylene)]trisphosphonic acid	C₃H₁₂NO₉P₃ 299.05 298.972490523
HMDB0258118	[Hydroxy-[[(2R,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate	C₁₀H₁₇N₂O₁₄P₃ 482.167 481.989264229	Blood
HMDB0038373 79136-97-3	[Gallocatechin(4alpha->8)]2catechin	C₄₅H₃₈O₂₀ 898.7712 898.195643656
HMDB0301933	[Epicatechin-(4beta->8)]2-epicatechin 3'''-gallate	C₅₂H₄₂O₂₂ 1018.8767 1018.216773028
HMDB0247158	[D-Met2, Pro5]-enkephalinamide	C₃₀H₄₀N₆O₆S 612.75 612.273004206	Blood

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