Exact Mass: 582.1220796

Exact Mass Matches: 582.1220796

Found 87 metabolites which its exact mass value is equals to given mass value 582.1220796, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Asperuloside tetraacetate

Asperuloside tetraacetate

C26H30O15 (582.158463)


   

Norrubrofusarin 6-beta-gentiobioside

5,8-dihydroxy-2-methyl-6-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-4H-benzo[g]chromen-4-one

C26H30O15 (582.158463)


Norrubrofusarin 6-beta-gentiobioside is found in coffee and coffee products. Norrubrofusarin 6-beta-gentiobioside is a constituent of the seeds of Cassia tora (charota)

   

5'-Methoxybilobetin

8-[5-(5,7-dihydroxy-4-oxo-4H-chromen-2-yl)-2,3-dimethoxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one

C32H22O11 (582.1162062)


5-Methoxybilobetin is found in fats and oils. 5-Methoxybilobetin is isolated from Ginkgo biloba (ginkgo). Isolated from Ginkgo biloba (ginkgo). 5-Methoxybilobetin is found in ginkgo nuts and fats and oils.

   

Ivosidenib

2-(2-chlorophenyl)-2-{1-[1-(4-cyanopyridin-2-yl)-5-oxopyrrolidin-2-yl]-N-(5-fluoropyridin-3-yl)formamido}-N-(3,3-difluorocyclobutyl)acetamide

C28H22ClF3N6O3 (582.1393928)


   

(2R)-Naringenin 8-C-alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranoside

(2R)-8-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2R,3R,4R,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]oxy}oxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one

C26H30O15 (582.158463)


(2r)-naringenin 8-c-alpha-l-rhamnopyranosyl-(1->2)-beta-d-glucopyranoside is soluble (in water) and a very weakly acidic compound (based on its pKa). (2r)-naringenin 8-c-alpha-l-rhamnopyranosyl-(1->2)-beta-d-glucopyranoside can be found in loquat, which makes (2r)-naringenin 8-c-alpha-l-rhamnopyranosyl-(1->2)-beta-d-glucopyranoside a potential biomarker for the consumption of this food product.

   
   

Podocarpusflavanone

2,3-Dihydroheveaflavone

C33H26O10 (582.1525896)


   
   

4)-glucoside

Okanin 4-alpha-L-arabinofuranosyl-(1-

C26H30O15 (582.158463)


   

2,3-Dihydrosciadopitysin

2,3-Dihydrosciadopitysin

C33H26O10 (582.1525896)


   

6)-glucoside

5,7,3,4-Tetrahydroxyflavanone 7-alpha-L-arabinofuranosyl- (1->6) -glucoside

C26H30O15 (582.158463)


   
   

2'-O-Vanilloylvitexin

2- (4-Hydroxyphenyl) -5,7-dihydroxy-8- (2-O-vanilloyl-beta-D-glucopyranosyl) -4H-1-benzopyran-4-one

C29H26O13 (582.1373346)


   

Perfoliatumin B

5,7,3,4-Tetrahydroxyflavone 6-C- (6"-O-p-methoxybenzoylglucoside)

C29H26O13 (582.1373346)


   

2,3-Dihydroochnaflavone 7,4,7-O-trimethyl ether

2,3-Dihydroochnaflavone 7,4,7-O-trimethyl ether

C33H26O10 (582.1525896)


   

2,3-dihydrorobustaflavone 7,4,7-trimethyl ether

2,3-dihydrorobustaflavone 7,4,7-trimethyl ether

C33H26O10 (582.1525896)


   

Polygalaxanthone V

Polygalaxanthone V

C26H30O15 (582.158463)


   

4-O-Demethylknipholone-4-beta-D-glucopyranoside

4-O-Demethylknipholone-4-beta-D-glucopyranoside

C29H26O13 (582.1373346)


   

Flavanone base + 4O, O-Hex, C-Pen

Flavanone base + 4O, O-Hex, C-Pen

C26H30O15 (582.158463)


Annotation level-3

   

2,6-Di-Me ether,8-O-primeveroside-1,2,6,8-Tetrahydroxyxanthone

2,6-Di-Me ether,8-O-primeveroside-1,2,6,8-Tetrahydroxyxanthone

C26H30O15 (582.158463)


   
   
   
   

6-O-[alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranosyl]-1,3-dihydroxy-7-methoxyxanthone|polygalaxanthone V

6-O-[alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranosyl]-1,3-dihydroxy-7-methoxyxanthone|polygalaxanthone V

C26H30O15 (582.158463)


   

2,8-Di-Me ether,1-O-primeveroside-1,2,6,8-Tetrahydroxyxanthone

2,8-Di-Me ether,1-O-primeveroside-1,2,6,8-Tetrahydroxyxanthone

C26H30O15 (582.158463)


   
   
   

7-Hydroxy-3,8-dimethoxy-1--xanthon|7-hydroxy-3,8-dimethoxyxanthone-1-O-[beta-D-xylosyl(1->6)]-beta-D-glucopyranoside|gentiabavaroside|Gentiacaulosid

7-Hydroxy-3,8-dimethoxy-1--xanthon|7-hydroxy-3,8-dimethoxyxanthone-1-O-[beta-D-xylosyl(1->6)]-beta-D-glucopyranoside|gentiabavaroside|Gentiacaulosid

C26H30O15 (582.158463)


   

2,3-Dihydroheveaflavone

2,3-Dihydroheveaflavone

C33H26O10 (582.1525896)


   
   

callophycoic acid C

callophycoic acid C

C27H36Br2O4 (582.0980175999999)


A dibenzooxepine diterpenoid that is hexahydrodibenzo[b,e]oxepine-2-carboxylic acid with an isolated double bond between positions 6a and 7 and is substituted by a bromo, 2-[(1S,3S,6S)-3-bromo-6-hydroxy-2,2,6-trimethylcyclohexyl]ethyl and a methyl group at positions 9, 10 and 10 respectively (the 9S,10S,10aR stereoisomer). It is isolated from the Fijian red alga Callophycus serratus and exhibits antibacterial, antimalarial and anticancer activities.

   

Okanin 4-alpha-L-arabinofuranosyl-(1->4)-glucoside

Okanin 4-alpha-L-arabinofuranosyl-(1->4)-glucoside

C26H30O15 (582.158463)


   

1-O-[beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranosyl]-8-hydroxy-3,5-dimethoxyxanthone

1-O-[beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranosyl]-8-hydroxy-3,5-dimethoxyxanthone

C26H30O15 (582.158463)


   
   

5,7,3,4-Tetrahydroxyflavanone 7-alpha-L-arabinofuranosyl-(1->6)-glucoside

5,7,3,4-Tetrahydroxyflavanone 7-alpha-L-arabinofuranosyl-(1->6)-glucoside

C26H30O15 (582.158463)


   

EGCG-ph|epigallocatechin-3-O-gallat-(4beta-2)-phloroglucinol|epigallocatechin-3-O-gallate-(4beta->2)-ph

EGCG-ph|epigallocatechin-3-O-gallat-(4beta-2)-phloroglucinol|epigallocatechin-3-O-gallate-(4beta->2)-ph

C28H22O14 (582.1009512)


   
   

sucro-neolambertillin

sucro-neolambertillin

C26H30O15 (582.158463)


   

quercetin 3-O-(6-O-phenylacetyl)-beta-D-glucopyranoside|thotneoside B

quercetin 3-O-(6-O-phenylacetyl)-beta-D-glucopyranoside|thotneoside B

C29H26O13 (582.1373346)


   

2?,3?-dihydroxy-4?-methoxydibenzoyl-4?-O-beta-D-xylopyranosyl-(1?6)-beta-D-glucopyranoside|sophodibenzoside A

2?,3?-dihydroxy-4?-methoxydibenzoyl-4?-O-beta-D-xylopyranosyl-(1?6)-beta-D-glucopyranoside|sophodibenzoside A

C26H30O15 (582.158463)


   

2?,4?-dihydroxy-3?-methoxydibenzoyl-4?-O-beta-D-xylopyranosyl-(1?6)-beta-D-glucopyranoside|sophodibenzoside J

2?,4?-dihydroxy-3?-methoxydibenzoyl-4?-O-beta-D-xylopyranosyl-(1?6)-beta-D-glucopyranoside|sophodibenzoside J

C26H30O15 (582.158463)


   

hedyotosides B|maltol 6?-O-(5-O-caffeoyl)-beta-d-apiofuranosyl-beta-d-glucopyranoside|shimobashiraside A

hedyotosides B|maltol 6?-O-(5-O-caffeoyl)-beta-d-apiofuranosyl-beta-d-glucopyranoside|shimobashiraside A

C26H30O15 (582.158463)


   

7-O-[alpha-L-rhamnopyranosyl-(1?2)-beta-D-glucopyranosyl]-1,8-dihydroxy-3-methoxyxanthone|kouitchenside I

7-O-[alpha-L-rhamnopyranosyl-(1?2)-beta-D-glucopyranosyl]-1,8-dihydroxy-3-methoxyxanthone|kouitchenside I

C26H30O15 (582.158463)


   

7-O-(α-L-rhamnopyranosyl)-8-O-(β-D-glucopyranosyl)-1-hydroxy-3-methoxyxanthone|kouitchenside J

7-O-(α-L-rhamnopyranosyl)-8-O-(β-D-glucopyranosyl)-1-hydroxy-3-methoxyxanthone|kouitchenside J

C26H30O15 (582.158463)


   

Acethyltectograndone

Acethyltectograndone

C32H22O11 (582.1162062)


   

2?,3?-dihydroxy-4?-methoxydibenzoyl-4?-O-beta-D-apiofuranosyl-(1?6)-beta-D-glucopyranoside|sophodibenzoside B

2?,3?-dihydroxy-4?-methoxydibenzoyl-4?-O-beta-D-apiofuranosyl-(1?6)-beta-D-glucopyranoside|sophodibenzoside B

C26H30O15 (582.158463)


   

(2R,3R)-dihydrokaempferol 3-O-beta-D-apiofuranosyl-(1?6)-beta-D-glucopyranoside|pteleifoside F

(2R,3R)-dihydrokaempferol 3-O-beta-D-apiofuranosyl-(1?6)-beta-D-glucopyranoside|pteleifoside F

C26H30O15 (582.158463)


   

callophycoic acid D

callophycoic acid D

C27H36Br2O4 (582.0980175999999)


A dibenzooxepine diterpenoid that is hexahydrodibenzo[b,e]oxepine-2-carboxylic acid with an isolated double bond between positions 6 and 6a and is substituted by a bromo, 2-[(1S,3S,6S)-3-bromo-6-hydroxy-2,2,6-trimethylcyclohexyl]ethyl and a methyl group at positions 9, 10 and 10 respectively (the 9S,10S,10aR stereoisomer). An isomer of callophycoic acid C, it is isolated from the Fijian red alga Callophycus serratus and exhibits antibacterial, antimalarial and anticancer activities.

   

Penta-Ac-Dothistromin

Penta-Ac-Dothistromin

C28H22O14 (582.1009512)


   

luteolin 6,8-di-C-alpha-L-arabinopyranoside

luteolin 6,8-di-C-alpha-L-arabinopyranoside

C25H26O16 (582.1220796)


   

2,3-dihydroamentoflavone 7,4,7-trimethyl ether

2,3-dihydroamentoflavone 7,4,7-trimethyl ether

C33H26O10 (582.1525896)


   
   
   

M-4-demethylkhipholone-2-O-beta-D-glucopyranoside

M-4-demethylkhipholone-2-O-beta-D-glucopyranoside

C29H26O13 (582.1373346)


   
   

2-O-Vanilloylvitexin

2-O-Vanilloylvitexin

C29H26O13 (582.1373346)


   
   

(2S)-2,3-dihydro-6-methylginkgetin|2,3-dihydro-6-methylginkgetin

(2S)-2,3-dihydro-6-methylginkgetin|2,3-dihydro-6-methylginkgetin

C33H26O10 (582.1525896)


   

Isogentiacanlosid

Isogentiacanlosid

C26H30O15 (582.158463)


   
   
   

4-O-[alpha-L-Arabinofuranosyl(1鈥樏傗垎4)-beta-D-glucopyranoside]-2,3,3,4,4-Pentahydroxychalcone

4-O-[alpha-L-Arabinofuranosyl(1鈥樏傗垎4)-beta-D-glucopyranoside]-2,3,3,4,4-Pentahydroxychalcone

C26H30O15 (582.158463)


   

α-Glucosidase-IN-24

1-Hydroxy-2,6-dimethoxy-8-[(6-O-beta-D-xylopyranosyl-beta-D-glucopyranosyl)oxy]-9H-xanthen-9-one

C26H30O15 (582.158463)


1-Hydroxy-2,6-dimethoxy-8-(6-O-beta-D-xylopyranosyl-beta-D-glucopyranosyloxy)xanthone is a natural product found in Swertia kouitchensis with data available.

   

Norrubrofusarin 6-b-gentiobioside

5,8-dihydroxy-2-methyl-6-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-4H-benzo[g]chromen-4-one

C26H30O15 (582.158463)


   

5-Methoxybilobetin

8-[5-(5,7-dihydroxy-4-oxo-4H-chromen-2-yl)-2,3-dimethoxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one

C32H22O11 (582.1162062)


   

AG-120

Ivosidenib

C28H22ClF3N6O3 (582.1393928)


C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C137826 - Isocitrate Dehydrogenase Inhibitor > C168618 - IDH1 inhibitor L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors IDH1 Inhibitor 8 (91) is isocitrate dehydrogenase 1 (IDH1) inhibitor. IDH1 Inhibitor 8 can be used for the research of cancer[1]. Ivosidenib (AG-120) is an orally active inhibitor of isocitrate dehydrogenase 1 mutant (mIDH1) enzyme, it exhibits profound d-2-hydroxyglutatrate (2-HG) lowering in vivo. Ivosidenib (AG-120) has the potential for AML therapy due to its acceptable safety profile and clinical activity[1].

   
   

1,3-bis(3-chloropropyl)tetrakis-(trimethylsiloxy)disiloxane,tech-95

1,3-bis(3-chloropropyl)tetrakis-(trimethylsiloxy)disiloxane,tech-95

C18H48Cl2O5Si6 (582.1494298)


   
   

(1S)​-1-​(Diphenylphosphino)​-​2-​[(1R)​-​1-​(diphenylphosphino)​ethyl]ferrocene

(1S)​-1-​(Diphenylphosphino)​-​2-​[(1R)​-​1-​(diphenylphosphino)​ethyl]ferrocene

C36H32FeP2 (582.1328522)


   
   

(2-(F-Hexyl)ethyl) dimorpholinophosphoramidate

(2-(F-Hexyl)ethyl) dimorpholinophosphoramidate

C16H20F13N2O4P (582.0953046)


   
   

(2R)-Naringenin 8-C-alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranoside

(2R)-Naringenin 8-C-alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranoside

C26H30O15 (582.158463)


   

4-O-demethylknipholone-4-O-beta-D-glucopyranoside

4-O-demethylknipholone-4-O-beta-D-glucopyranoside

C29H26O13 (582.1373346)


An anthraquinone that is knipholone in which the O-methyl group is replaced by a beta-D-glucopyranosyl group. It is isolated from the roots of Bulbine frutescens and exhibits trypanocidal and antiplasmodial activities.

   

Norrubrofusarin 6-beta-gentiobioside

Norrubrofusarin 6-beta-gentiobioside

C26H30O15 (582.158463)


   

(R,S)-Ivosidenib

(R,S)-Ivosidenib

C28H22ClF3N6O3 (582.1393928)


(R,S)-Ivosidenib ((R,S)-AG-120) is the less active enantiomer of Ivosidenib (AG-120)[1].

   

1-(3-acetyl-2,6-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-4,5-dihydroxy-2-methylanthracene-9,10-dione

1-(3-acetyl-2,6-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-4,5-dihydroxy-2-methylanthracene-9,10-dione

C29H26O13 (582.1373346)


   
   

5-hydroxy-8-{5-[(2s)-5-hydroxy-7-methoxy-4-oxo-2,3-dihydro-1-benzopyran-2-yl]-2-methoxyphenyl}-2-(4-hydroxyphenyl)-7-methoxychromen-4-one

5-hydroxy-8-{5-[(2s)-5-hydroxy-7-methoxy-4-oxo-2,3-dihydro-1-benzopyran-2-yl]-2-methoxyphenyl}-2-(4-hydroxyphenyl)-7-methoxychromen-4-one

C33H26O10 (582.1525896)


   

(1r,14s,15s)-14-bromo-15-[2-(3-bromo-6-hydroxy-2,2,6-trimethylcyclohexyl)ethyl]-15-methyl-9-oxatricyclo[9.4.0.0³,⁸]pentadeca-3,5,7,10-tetraene-5-carboxylic acid

(1r,14s,15s)-14-bromo-15-[2-(3-bromo-6-hydroxy-2,2,6-trimethylcyclohexyl)ethyl]-15-methyl-9-oxatricyclo[9.4.0.0³,⁸]pentadeca-3,5,7,10-tetraene-5-carboxylic acid

C27H36Br2O4 (582.0980175999999)


   

2-hydroxy-1,6-dimethoxy-8-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}xanthen-9-one

2-hydroxy-1,6-dimethoxy-8-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}xanthen-9-one

C26H30O15 (582.158463)


   

(4s,5z,6s)-5-(2-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}ethylidene)-4-(2-methoxy-2-oxoethyl)-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylic acid

(4s,5z,6s)-5-(2-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}ethylidene)-4-(2-methoxy-2-oxoethyl)-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylic acid

C26H30O15 (582.158463)


   

(1r,14s,15s)-14-bromo-15-[2-(3-bromo-6-hydroxy-2,2,6-trimethylcyclohexyl)ethyl]-15-methyl-9-oxatricyclo[9.4.0.0³,⁸]pentadeca-3,5,7,11-tetraene-5-carboxylic acid

(1r,14s,15s)-14-bromo-15-[2-(3-bromo-6-hydroxy-2,2,6-trimethylcyclohexyl)ethyl]-15-methyl-9-oxatricyclo[9.4.0.0³,⁸]pentadeca-3,5,7,11-tetraene-5-carboxylic acid

C27H36Br2O4 (582.0980175999999)


   

(7s,8s,11r,12s,15s)-7,11-dibromo-12,21-dihydroxy-4,8,12-trimethyl-15-(prop-1-en-2-yl)-16-oxatricyclo[16.3.1.0³,⁸]docosa-1(22),3,18,20-tetraen-17-one

(7s,8s,11r,12s,15s)-7,11-dibromo-12,21-dihydroxy-4,8,12-trimethyl-15-(prop-1-en-2-yl)-16-oxatricyclo[16.3.1.0³,⁸]docosa-1(22),3,18,20-tetraen-17-one

C27H36Br2O4 (582.0980175999999)