Exact Mass: 530.0696528
Exact Mass Matches: 530.0696528
Found 58 metabolites which its exact mass value is equals to given mass value 530.0696528,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
dTDP-3-oxo-4,6-dideoxy-D-glucose
dTDP-3-oxo-4,6-dideoxy-D-glucose; dTDP-3-oxo-4,6-dideoxy-alpha-D-glucose; dTDP-3-dehydro-4,6-dideoxy-alpha-D-glucopyranose
dTDP 1-ester with 2,6-dideoxy-L-erythro-hexopyranos-3-ulose
dTDP-2,6-dideoxy-L-erythro-hexos-3-ulose; dTDP 1-ester with 2,6-dideoxy-L-erythro-hexopyranos-3-ulose
6-O-malonyl-3-O-beta-D-glucopyranosyl-6,6a-dehydromaackiain
6-O-malonyl-3-O-beta-D-glucopyranosyl-6,6a-dehydromaackiain
Ustilaginoidin B
Ustilaginoidin B
A binaphthopyran resulting from the formal oxidative coupling at positions 9 of molecules of 5,6,8-trihydroxy-2-methyl-4H-benzo[g]chromen-4-one and 5,6,8-trihydroxy-2-(hydroxymethyl)-4H-benzo[g]chromen-4-one.
(8R,15S)-15-acetoxy-4,11,14-trihydroxy-6,9-dimethyl-3,7-dioxo-7,8-dihydro-3H-8r,14bc-methano-naphtho[1,2:6,7]cyclohepta[de]isochromene-12,13-dicarboxylic acid anhydride|(8S,16S)-16-acetoxy-4,11,15-trihydroxy-6,9-dimethyl-8H-8r,15bc-methano-benzo[de]cyclohepta[1,2-g;3,4,5-de]diisochromene-3,7,12,14-tetraone|Xenoclauxin
(8R,15S)-15-acetoxy-4,11,14-trihydroxy-6,9-dimethyl-3,7-dioxo-7,8-dihydro-3H-8r,14bc-methano-naphtho[1,2:6,7]cyclohepta[de]isochromene-12,13-dicarboxylic acid anhydride|(8S,16S)-16-acetoxy-4,11,15-trihydroxy-6,9-dimethyl-8H-8r,15bc-methano-benzo[de]cyclohepta[1,2-g;3,4,5-de]diisochromene-3,7,12,14-tetraone|Xenoclauxin
((R)-3-(3-fluoro-4-(6-(2-methyl-2H-tetrazol-5-yl)pyridin-3-yl)phenyl)-2-oxooxazolidin-5-yl)methyl trihydrogen diphosphate
((R)-3-(3-fluoro-4-(6-(2-methyl-2H-tetrazol-5-yl)pyridin-3-yl)phenyl)-2-oxooxazolidin-5-yl)methyl trihydrogen diphosphate
dTDP-beta-L-daunosamine(1-)
dTDP-beta-L-daunosamine(1-)
A nucleotide-sugar oxoanion that is the conjugate base of dTDP-beta-L-daunosamine, arising from deprotonation of the diphosphate group and protonation of the amino group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
dTDP-3-azaniumyl-3,4,6-trideoxy-alpha-D-glucose(1-)
dTDP-3-azaniumyl-3,4,6-trideoxy-alpha-D-glucose(1-)
[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl] [[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphoryl] phosphate
[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl] [[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphoryl] phosphate
[(2R,4R,5R,6S)-4-azaniumyl-5-hydroxy-6-methyloxan-2-yl] [[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphoryl] phosphate
[(2R,4R,5R,6S)-4-azaniumyl-5-hydroxy-6-methyloxan-2-yl] [[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphoryl] phosphate
[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-yl]methyl (2R,3S,6R)-3-hydroxy-6-methyl-4-oxotetrahydro-2H-pyran-2-yl dihydrogen diphosphate
[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-yl]methyl (2R,3S,6R)-3-hydroxy-6-methyl-4-oxotetrahydro-2H-pyran-2-yl dihydrogen diphosphate
biochanin A 7-O-beta-D-glucoside 6-O-malonate(2-)
biochanin A 7-O-beta-D-glucoside 6-O-malonate(2-)
C25H22O13-2 (530.1060362000001)
4-[6-(Ethylamino)-3-(ethylimino)-2,7-dimethyl-3H-xanthen-9-yl]benzene-1,3-disulfonic acid
4-[6-(Ethylamino)-3-(ethylimino)-2,7-dimethyl-3H-xanthen-9-yl]benzene-1,3-disulfonic acid
C25H26N2O7S2 (530.1181366000001)
dTDP-4-dehydro-2,6-dideoxy-alpha-D-glucose
dTDP-4-dehydro-2,6-dideoxy-alpha-D-glucose
A dTDP-sugar having 4-dehydro-2,6-dideoxy-alpha-D-glucose as the sugar component.
4-[3,5-dihydroxy-4-(3,4,5-trihydroxyphenoxy)phenoxy]-5-(2,4,6-trihydroxyphenoxy)benzene-1,2,3-triol
4-[3,5-dihydroxy-4-(3,4,5-trihydroxyphenoxy)phenoxy]-5-(2,4,6-trihydroxyphenoxy)benzene-1,2,3-triol
6,7-dihydroxy-3-methoxy-8-[2-oxo-2h-1-benzo-pyran-7-(o-β-d-glucopyranosyl)-8-yl]-2h-1-benzopyran-2-one
NA
{"Ingredient_id": "HBIN012070","Ingredient_name": "6,7-dihydroxy-3-methoxy-8-[2-oxo-2h-1-benzo-pyran-7-(o-\u03b2-d-glucopyranosyl)-8-yl]-2h-1-benzopyran-2-one","Alias": "NA","Ingredient_formula": "C25H22O13","Ingredient_Smile": "COC1=CC2=CC(=C(C(=C2OC1=O)C3=C(C=CC4=C3OC(=O)C=C4)OC5C(C(C(C(O5)CO)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5994","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-oxo-3-{[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(4-{8-oxo-2h-[1,3]dioxolo[4,5-g]chromen-7-yl}phenoxy)oxan-2-yl]methoxy}propanoic acid
3-oxo-3-{[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(4-{8-oxo-2h-[1,3]dioxolo[4,5-g]chromen-7-yl}phenoxy)oxan-2-yl]methoxy}propanoic acid
2-[3,5-dihydroxy-2,4-bis(3,4,5-trihydroxyphenoxy)phenoxy]benzene-1,3,5-triol
2-[3,5-dihydroxy-2,4-bis(3,4,5-trihydroxyphenoxy)phenoxy]benzene-1,3,5-triol
(1r,3r,4r,7r,8s,12s,13s)-4-chloro-3,7-dihydroxy-13-(2-hydroxy-3,4-dimethoxyphenyl)-17-methyl-9-oxa-14,15-dithia-10,17-diazatetracyclo[10.3.2.0¹,¹⁰.0³,⁸]heptadec-5-ene-11,16-dione
(1r,3r,4r,7r,8s,12s,13s)-4-chloro-3,7-dihydroxy-13-(2-hydroxy-3,4-dimethoxyphenyl)-17-methyl-9-oxa-14,15-dithia-10,17-diazatetracyclo[10.3.2.0¹,¹⁰.0³,⁸]heptadec-5-ene-11,16-dione
4-chloro-3,7-dihydroxy-13-(2-hydroxy-3,4-dimethoxyphenyl)-17-methyl-9-oxa-14,15-dithia-10,17-diazatetracyclo[10.3.2.0¹,¹⁰.0³,⁸]heptadec-5-ene-11,16-dione
4-chloro-3,7-dihydroxy-13-(2-hydroxy-3,4-dimethoxyphenyl)-17-methyl-9-oxa-14,15-dithia-10,17-diazatetracyclo[10.3.2.0¹,¹⁰.0³,⁸]heptadec-5-ene-11,16-dione
(2s,3r,4s,5s,6r)-2-(2,4-dichloro-5-methoxy-3-methylphenoxy)-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-3,4,5-triol
(2s,3r,4s,5s,6r)-2-(2,4-dichloro-5-methoxy-3-methylphenoxy)-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-3,4,5-triol
C20H28Cl2O12 (530.0957748000001)
(2e)-3-[23-(carboxymethyl)-5,16-dihydroxy-3,10,14,21-tetraoxo-22-oxapentacyclo[11.11.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]tetracosa-1,4,6,8,12,15,17,19-octaen-12-yl]prop-2-enoic acid
(2e)-3-[23-(carboxymethyl)-5,16-dihydroxy-3,10,14,21-tetraoxo-22-oxapentacyclo[11.11.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]tetracosa-1,4,6,8,12,15,17,19-octaen-12-yl]prop-2-enoic acid
5-[2,6-dihydroxy-4-(2,4,6-trihydroxyphenoxy)phenoxy]-4-(3,4,5-trihydroxyphenoxy)benzene-1,2,3-triol
5-[2,6-dihydroxy-4-(2,4,6-trihydroxyphenoxy)phenoxy]-4-(3,4,5-trihydroxyphenoxy)benzene-1,2,3-triol
6,7-dihydroxy-3-methoxy-7'-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-[8,8'-bichromene]-2,2'-dione
6,7-dihydroxy-3-methoxy-7'-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-[8,8'-bichromene]-2,2'-dione
3-oxo-3-[(3,4,5-trihydroxy-6-{5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-1(20),2,4(8),9,13,15,17-heptaen-16-yloxy}oxan-2-yl)methoxy]propanoic acid
3-oxo-3-[(3,4,5-trihydroxy-6-{5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-1(20),2,4(8),9,13,15,17-heptaen-16-yloxy}oxan-2-yl)methoxy]propanoic acid
6,7-dihydroxy-3-methoxy-7'-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-[8,8'-bichromene]-2,2'-dione
6,7-dihydroxy-3-methoxy-7'-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-[8,8'-bichromene]-2,2'-dione
4,5,6-trihydroxy-2-methyl-9-[4,5,6-trihydroxy-2-(hydroxymethyl)-8-oxocyclohexa[g]chromen-9-yl]cyclohexa[g]chromen-8-one
4,5,6-trihydroxy-2-methyl-9-[4,5,6-trihydroxy-2-(hydroxymethyl)-8-oxocyclohexa[g]chromen-9-yl]cyclohexa[g]chromen-8-one
3-oxo-3-{[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-[(12s)-5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-1(20),2,4(8),9,13,15,17-heptaen-16-yloxy]oxan-2-yl]methoxy}propanoic acid
3-oxo-3-{[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-[(12s)-5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-1(20),2,4(8),9,13,15,17-heptaen-16-yloxy]oxan-2-yl]methoxy}propanoic acid
(1r,3r,4r,7r,8s,12s,13r)-4-chloro-3,7-dihydroxy-13-(2-hydroxy-3,4-dimethoxyphenyl)-17-methyl-9-oxa-14,15-dithia-10,17-diazatetracyclo[10.3.2.0¹,¹⁰.0³,⁸]heptadec-5-ene-11,16-dione
(1r,3r,4r,7r,8s,12s,13r)-4-chloro-3,7-dihydroxy-13-(2-hydroxy-3,4-dimethoxyphenyl)-17-methyl-9-oxa-14,15-dithia-10,17-diazatetracyclo[10.3.2.0¹,¹⁰.0³,⁸]heptadec-5-ene-11,16-dione