Exact Mass: 542.0916440000001

Exact Mass Matches: 542.0916440000001

Found 125 metabolites which its exact mass value is equals to given mass value 542.0916440000001, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Isochamaejasmin

(2S,3R)-3-[(2R,3S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

C30H22O10 (542.1212912)


Chamaejasmin is a natural product found in Brackenridgea zanguebarica, Stellera chamaejasme, and other organisms with data available. Isochamaejasmin is a biflavonoid that consists of two units of 5,7,4-trihydroxyflavanone joined together at position 3 and 3. It has a role as a plant metabolite. It is a biflavonoid and a hydroxyflavone. Isochamaejasmin is a natural product found in Brackenridgea zanguebarica, Stellera chamaejasme, and Ormocarpum kirkii with data available.

   
   

CMP-8-amino-3,8-dideoxy-beta-D-manno-octulosonate

CMP-8-amino-3,8-dideoxy-beta-D-manno-octulosonate; CMP-Kdo8N

C17H27N4O14P (542.1261332)


   

Yuccaol C

4-[(E)-2-(3,5-dihydroxy-4-methoxyphenyl)ethenyl]-4,6,6-trihydroxy-2-(4-hydroxyphenyl)-2H,2H-3,3-spirobi[[1]benzofuran]-2-one

C30H22O10 (542.1212912)


Yuccaol C is found in fruits. Yuccaol C is a constituent of the bark of Yucca schidigera (Mojave yucca). Constituent of the bark of Yucca schidigera (Mojave yucca). Yuccaol C is found in fruits.

   

4'-Methylisoscutellarein 8-(2'-sulfoglucoside)

(2-{[5,7-dihydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-8-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxidanesulphonic acid

C22H22O14S (542.0730232)


4-Methylisoscutellarein 8-(2-sulfoglucoside) is found in herbs and spices. 4-Methylisoscutellarein 8-(2-sulfoglucoside) is isolated from the roots of Althaea officinalis (marsh mallow). Isolated from the roots of Althaea officinalis (marsh mallow). 4-Methylisoscutellarein 8-(2-sulfoglucoside) is found in tea, herbs and spices, and root vegetables.

   

Chamaechromone

3-[1,1-bis(4-hydroxyphenyl)-3-oxo-3-(2,4,6-trihydroxyphenyl)propan-2-yl]-5,7-dihydroxy-4H-chromen-4-one

C30H22O10 (542.1212912)


   

Neochamaejasmin A

3-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one

C30H22O10 (542.1212912)


   

p-MPPI

4-iodo-N-{2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl}-N-(pyridin-2-yl)benzamide

C25H27IN4O2 (542.1178672)


   

Rhusflavanone

6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-8-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one

C30H22O10 (542.1212912)


   
   

(-)-biflavanone GB-1a

(-)-biflavanone GB-1a

C30H22O10 (542.1212912)


   
   

Chamaechromone

3-[1,1-bis(4-hydroxyphenyl)-3-oxo-3-(2,4,6-trihydroxyphenyl)propan-2-yl]-5,7-dihydroxy-4H-chromen-4-one

C30H22O10 (542.1212912)


Chamaechromone is a natural product found in Stellera chamaejasme and Daphne aurantiaca with data available. Chamaechromone is a biflavonoid ingredient isolated from the roots of Stellera chamaejasme L. (Thymelaeaceae). Chamaechromone possesses anti-hepatitis B virus (HBV) effects against the surface antigen of HBV (HBsAg) secretion and has insecticidal activities[1].

   
   

genkwanol A

[2R-(2alpha,3beta,8alpha,9alpha)]-3,4-Dihydro-3,4,5,6-tetrahydroxy-2,8-bis(4-hydroxyphenyl)-spiro[benzofuran-2(3H),9(8H)-[2H]furo[2,3-h][1]benzopyran]-3-one

C30H22O10 (542.1212912)


   
   
   
   
   

Tetrahydrohinokiflavone

(-)-Tetrahydrohinokiflavone

C30H22O10 (542.1212912)


   
   
   

2,2-(6,6-Dihydroxybiphenyl-3,3-diyl)bis(5,7-dihydroxychroman-4-one)

2,2-(6,6-Dihydroxybiphenyl-3,3-diyl)bis(5,7-dihydroxychroman-4-one)

C30H22O10 (542.1212912)


   

Tetrahydrorobustaflavone

Tetrahydrorobustaflavone

C30H22O10 (542.1212912)


   
   

Tetrahydroamentoflavone

Tetrahydroamentoflavone

C30H22O10 (542.1212912)


   

Succedaneaflavanone

Succedaneaflavanone

C30H22O10 (542.1212912)


   

Daphnodorin M

(4S,4aR,10aS,12S)-4,4a,13,14-Tetrahydro-4a,6,8-trihydroxy-4,12-bis(4-hydroxyphenyl)-1H,5H,12H-furo[3,4-b:2,3-h]bis[1]benzopyran-1,5-dione

C30H22O10 (542.1212912)


   
   

Daphnodorin N

(4S,4aR,10aS,12R)-4,4a,13,14-Tetrahydro-4a,6,8-trihydroxy-4,12-bis(4-hydroxyphenyl)-1H,5H,12H-furo[3,4-b:2,3-h]bis[1]benzopyran-1,5-dione

C30H22O10 (542.1212912)


   

Isoscutellarein 4-methyl ether 8-(2-sulfatoglucoside)

5,7,8-Trihydroxy-4-methoxyflavone 8- (2"-sulfatoglucoside)

C22H22O14S (542.0730232)


   
   
   
   

Daphnodorin B

Methanone, (3,4-dihydro-3,5-dihydroxy-2,8-bis(4-hydroxyphenyl)-2H-furo(2,3-h)-l-benzopyran-9-yl)(2,4,6-trihydroxyphenyl)-, trans-(-)-

C30H22O10 (542.1212912)


Daphnodorin B is a natural product found in Stellera chamaejasme, Daphne genkwa, and other organisms with data available.

   
   

Hyperidixanthone

Hyperidixanthone

C30H22O10 (542.1212912)


A natural product found in Hypericum chinense.

   
   

Penta-Ac-3,3,4,5,8-Pentahydroxy-7-methoxyflavone

Penta-Ac-3,3,4,5,8-Pentahydroxy-7-methoxyflavone

C26H22O13 (542.1060362000001)


   

5,6-O-beta-D-diglucopyranosylangelicin

5,6-O-beta-D-diglucopyranosylangelicin

C23H26O15 (542.1271646)


   
   
   

connorstictic acid tetra-acetate|tetraacetylconnorstictic acid

connorstictic acid tetra-acetate|tetraacetylconnorstictic acid

C26H22O13 (542.1060362000001)


   

(5aS,17S,20S)-1,7,9,15,17,20-Hexahydroxy-3,11-dimethyl-6H,14H-6c,13ac,5ar,14c-butan-1,2,3,4-tetrayl-cycloocta[1,2-b;5,6-b]dinaphthalin-5,8,13,16-tetraon|(5aS,17S,20S)-1,7,9,15,17,20-hexahydroxy-3,11-dimethyl-6H,14H-6c,13ac,5ar,14c-butane-1,2,3,4-tetrayl-cycloocta[1,2-b;5,6-b]dinaphthalene-5,8,13,16-tetraone

(5aS,17S,20S)-1,7,9,15,17,20-Hexahydroxy-3,11-dimethyl-6H,14H-6c,13ac,5ar,14c-butan-1,2,3,4-tetrayl-cycloocta[1,2-b;5,6-b]dinaphthalin-5,8,13,16-tetraon|(5aS,17S,20S)-1,7,9,15,17,20-hexahydroxy-3,11-dimethyl-6H,14H-6c,13ac,5ar,14c-butane-1,2,3,4-tetrayl-cycloocta[1,2-b;5,6-b]dinaphthalene-5,8,13,16-tetraone

C30H22O10 (542.1212912)


   

2,3,2,3-Tetrahydroochnaflavone

2,3,2",3"-Tetrahydroochnaflavone

C30H22O10 (542.1212912)


   
   
   

2,2,3,3-Tetrahydrohinokiflavone

2,2,3,3-Tetrahydrohinokiflavone

C30H22O10 (542.1212912)


   

5-O-[beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranosyl]-8-hydroxybergaptol

5-O-[beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranosyl]-8-hydroxybergaptol

C23H26O15 (542.1271646)


   
   
   

5,6-O-??-D-Diglucopyranosylangelicin

5,6-O-??-D-Diglucopyranosylangelicin

C23H26O15 (542.1271646)


   

Penta-Ac-3,3,4,5,7-Pentahydroxy-8-methoxyflavone

Penta-Ac-3,3,4,5,7-Pentahydroxy-8-methoxyflavone

C26H22O13 (542.1060362000001)


   
   
   
   

Chamaejasmine

(2R,3S)-3-[(2R,3S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

C30H22O10 (542.1212912)


Chamaejasmine is a natural product found in Enkleia siamensis, Stellera chamaejasme, and Enkleia malaccensis with data available.

   

Amentoflavanone

4H-1-Benzopyran-4-one, 8-[5-(3,4-dihydro-5,7-dihydroxy-4-oxo-2H-1-benzopyran-2-yl)-2-hydroxyphenyl]-2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)- [S-(R*,R*)]-

C30H22O10 (542.1212912)


Tetrahydroamentoflavone is a natural product found in Cycas beddomei, Schinus terebinthifolia, and other organisms with data available.

   

Neochamaejasmin B

(2S,3S)-3-[(2R,3S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

C30H22O10 (542.1212912)


Neochamaejasmin B is a natural product found in Stellera chamaejasme and Daphne feddei with data available.

   

Isoneochamaejasmin A

(2S,3S)-3-[(2R,3R)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

C30H22O10 (542.1212912)


   

3-[1,1-bis(4-hydroxyphenyl)-3-oxo-3-(2,4,6-trihydroxyphenyl)propan-2-yl]-5,7-dihydroxychromen-4-one

NCGC00385136-01!3-[1,1-bis(4-hydroxyphenyl)-3-oxo-3-(2,4,6-trihydroxyphenyl)propan-2-yl]-5,7-dihydroxychromen-4-one

C30H22O10 (542.1212912)


   

5-hydroxy-2-(4-hydroxyphenyl)-7-[[(2R,3S)-3,5,8-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-yl]oxy]chromen-4-one

NCGC00380474-01!5-hydroxy-2-(4-hydroxyphenyl)-7-[[(2R,3S)-3,5,8-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-yl]oxy]chromen-4-one

C30H22O10 (542.1212912)


   

(2R)-8-[(2R,3S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

NCGC00169705-02!(2R)-8-[(2R,3S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

C30H22O10 (542.1212912)


   

3-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

NCGC00180625-03!3-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

C30H22O10 (542.1212912)


   

(2S)-6-[(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-8-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

NCGC00385250-01!(2S)-6-[(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-8-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

C30H22O10 (542.1212912)


   

3-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

NCGC00180625-02!3-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

C30H22O10 (542.1212912)


   

(3S,4R)-3-[(3S,4R)-5,7-dihydroxy-4-(4-hydroxyphenyl)-2-oxo-3,4-dihydrochromen-3-yl]-5,7-dihydroxy-4-(4-hydroxyphenyl)-3,4-dihydrochromen-2-one

NCGC00179829-02!(3S,4R)-3-[(3S,4R)-5,7-dihydroxy-4-(4-hydroxyphenyl)-2-oxo-3,4-dihydrochromen-3-yl]-5,7-dihydroxy-4-(4-hydroxyphenyl)-3,4-dihydrochromen-2-one

C30H22O10 (542.1212912)


   

(2R)-8-[(2R,3S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

(2R)-8-[(2R,3S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

C30H22O10 (542.1212912)


   

(2S)-6-[(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-8-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

(2S)-6-[(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-8-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

C30H22O10 (542.1212912)


   

(3S,4R)-3-[(3S,4R)-5,7-dihydroxy-4-(4-hydroxyphenyl)-2-oxo-3,4-dihydrochromen-3-yl]-5,7-dihydroxy-4-(4-hydroxyphenyl)-3,4-dihydrochromen-2-one

(3S,4R)-3-[(3S,4R)-5,7-dihydroxy-4-(4-hydroxyphenyl)-2-oxo-3,4-dihydrochromen-3-yl]-5,7-dihydroxy-4-(4-hydroxyphenyl)-3,4-dihydrochromen-2-one

C30H22O10 (542.1212912)


   

3-[1,1-bis(4-hydroxyphenyl)-3-oxo-3-(2,4,6-trihydroxyphenyl)propan-2-yl]-5,7-dihydroxychromen-4-one

3-[1,1-bis(4-hydroxyphenyl)-3-oxo-3-(2,4,6-trihydroxyphenyl)propan-2-yl]-5,7-dihydroxychromen-4-one

C30H22O10 (542.1212912)


   

Radicalisin

Radicalisin

C30H22O10 (542.1212912)


CONFIDENCE isolated standard

   
   

(2R)-8-[(2R,3S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one [IIN-based: Match]

NCGC00169705-02!(2R)-8-[(2R,3S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one [IIN-based: Match]

C30H22O10 (542.1212912)


   

Yuccaol C

4-[(E)-2-(3,5-dihydroxy-4-methoxyphenyl)ethenyl]-4,6,6-trihydroxy-2-(4-hydroxyphenyl)-2H,2H-3,3-spirobi[[1]benzofuran]-2-one

C30H22O10 (542.1212912)


   

4'-Methylisoscutellarein 8-(2''-sulfoglucoside)

(2-{[5,7-dihydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-8-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxidanesulfonic acid

C22H22O14S (542.0730232)


   

(S,S)-N-BENZYL-3,4-TRANS-DIMESOLATEPYRROLIDINE

(S,S)-N-BENZYL-3,4-TRANS-DIMESOLATEPYRROLIDINE

C25H25F3O6S2 (542.1044586)


   
   

Bis(4-tert-butylphenyl)iodoniumtrifluoromethanesulfonate

Bis(4-tert-butylphenyl)iodoniumtrifluoromethanesulfonate

C21H26F3IO3S (542.0599432)


   

2,9-diphenylanthra[2,1,9-def:6,5,10-def]diisoquinoline-1,3,8,10(2H,9H)-tetrone

2,9-diphenylanthra[2,1,9-def:6,5,10-def]diisoquinoline-1,3,8,10(2H,9H)-tetrone

C36H18N2O4 (542.1266508)


   

2-BROMO-4-(3-(PYRIDIN-2-YL)-1-TRITYL-1H-PYRAZOL-4-YL)PYRIDINE

2-BROMO-4-(3-(PYRIDIN-2-YL)-1-TRITYL-1H-PYRAZOL-4-YL)PYRIDINE

C32H23BrN4 (542.1105978)


   

(R)-(+)-2,2-Bis(di-2-furanylphosphino)-6,6-dimethoxy-1,1-biphenyl,min.

(R)-(+)-2,2-Bis(di-2-furanylphosphino)-6,6-dimethoxy-1,1-biphenyl,min.

C30H24O6P2 (542.1048064)


   

p-MPPI

4-IODO-N-[2-[4-(METHOXYPHENYL)-1-PIPERAZINYL]ETHYL]-N-2-PYRIDINYL-BENZAMIDE HYDROCHLORIDE

C25H27IN4O2 (542.1178672)


D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists

   

Disodium 4-dodecyl-2,4-oxydibenzenesulfonate

Disodium 4-dodecyl-2,4-oxydibenzenesulfonate

C24H32Na2O7S2 (542.1384762)


   

1-beta-D-Ribofuranosylinosine 5-(trihydrogen diphosphate) intramol. P,5-ester

1-beta-D-Ribofuranosylinosine 5-(trihydrogen diphosphate) intramol. P,5-ester

C15H20N4O14P2 (542.045124)


   

Elismetrep

Elismetrep

C27H21F3N2O5S (542.1123212)


C78272 - Agent Affecting Nervous System

   

4-[(E)-2-(3,5-dihydroxy-4-methoxyphenyl)ethenyl]-4,6,6-trihydroxy-2-(4-hydroxyphenyl)spiro[1-benzofuran-3,3-2H-1-benzofuran]-2-one

4-[(E)-2-(3,5-dihydroxy-4-methoxyphenyl)ethenyl]-4,6,6-trihydroxy-2-(4-hydroxyphenyl)spiro[1-benzofuran-3,3-2H-1-benzofuran]-2-one

C30H22O10 (542.1212912)


   

dTDP-alpha-D-forosamine(1-)

dTDP-alpha-D-forosamine(1-)

C18H30N3O12P2- (542.1304660000001)


A nucleotide-sugar oxoanion arising from deprotonation of the diphosphate OH groups and protonation of the amino group of dTDP-alpha-D-forosamine; major species at pH 7.3.

   

dTDP-4-dehydro-3-C-methyl-2,6-dideoxy-beta-L-allose

dTDP-4-dehydro-3-C-methyl-2,6-dideoxy-beta-L-allose

C17H24N2O14P2-2 (542.0702744)


   

dTDP-(2R,4S,6S)-4-amino-2,4-dimethyloxan-3-one

dTDP-(2R,4S,6S)-4-amino-2,4-dimethyloxan-3-one

C17H26N3O13P2- (542.0940826)


   

dTDP-(2S,4S,6S)-4-amino-2,4-dimethyloxan-3-one

dTDP-(2S,4S,6S)-4-amino-2,4-dimethyloxan-3-one

C17H26N3O13P2- (542.0940826)


   

dTDP-4-dehydro-3-C-methyl-2,6-dideoxy-beta-L-mannose

dTDP-4-dehydro-3-C-methyl-2,6-dideoxy-beta-L-mannose

C17H24N2O14P2-2 (542.0702744)


   

dTDP-4-dehydro-3-C-methyl-2,6-dideoxy-alpha-D-glucose

dTDP-4-dehydro-3-C-methyl-2,6-dideoxy-alpha-D-glucose

C17H24N2O14P2-2 (542.0702744)


   

CMP-8-amino-3,8-dideoxy-alpha-D-manno-oct-2-ulosonic acid

CMP-8-amino-3,8-dideoxy-alpha-D-manno-oct-2-ulosonic acid

C17H27N4O14P (542.1261332)


A CMP-sugar having 8-amino-3,8-dideoxy-alpha-D-manno-oct-2-ulosonic acid as the sugar component.

   

Dimeric rubrofusarin

Dimeric rubrofusarin

C30H22O10 (542.1212912)


   

dTDP-3-N-methylamino-4-oxo-2,3,6-trideoxy-alpha-D-glucose

dTDP-3-N-methylamino-4-oxo-2,3,6-trideoxy-alpha-D-glucose

C17H26N3O13P2- (542.0940826)


   

(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[[4-(1,3-oxazol-5-yl)pyridin-1-ium-1-yl]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[[4-(1,3-oxazol-5-yl)pyridin-1-ium-1-yl]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

C22H20N7O6S2+ (542.0916440000001)


   

5-O-[(S)-{[(S)-{[(2R,3R,4S)-3,4-Dihydroxypyrrolidin-2-YL]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine

5-O-[(S)-{[(S)-{[(2R,3R,4S)-3,4-Dihydroxypyrrolidin-2-YL]methoxy}(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]adenosine

C15H24N6O12P2 (542.0927404)


COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

2-(4-Morpholinyl)-5-[[oxo-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)phenyl]-3-furanyl]methyl]amino]benzoic acid methyl ester

2-(4-Morpholinyl)-5-[[oxo-[2-(trifluoromethyl)-5-[4-(trifluoromethyl)phenyl]-3-furanyl]methyl]amino]benzoic acid methyl ester

C25H20F6N2O5 (542.1276342)


   

4-methoxyphenyl 3-O-(3-O-sulfo-beta-D-glucopyranuronosyl)-beta-D-galactopyranoside

4-methoxyphenyl 3-O-(3-O-sulfo-beta-D-glucopyranuronosyl)-beta-D-galactopyranoside

C19H26O16S (542.0941516)


   

[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4S)-3,4-dihydroxy-2,3,4,5-tetrahydrofuran-5-ylium-2-yl]methyl hydrogen phosphate

[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4S)-3,4-dihydroxy-2,3,4,5-tetrahydrofuran-5-ylium-2-yl]methyl hydrogen phosphate

C15H22N5O13P2+ (542.0689322000001)


   
   

5-hydroxy-2-(4-hydroxyphenyl)-7-[[(2R,3S)-3,5,8-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-yl]oxy]chromen-4-one

5-hydroxy-2-(4-hydroxyphenyl)-7-[[(2R,3S)-3,5,8-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromen-7-yl]oxy]chromen-4-one

C30H22O10 (542.1212912)


   

Isochamaejasmin

(2S,3R)-3-[(2R,3S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one

C30H22O10 (542.1212912)


Isochamaejasmin is a biflavonoid that consists of two units of 5,7,4-trihydroxyflavanone joined together at position 3 and 3. It has a role as a plant metabolite. It is a biflavonoid and a hydroxyflavone. Isochamaejasmin is a natural product found in Brackenridgea zanguebarica, Stellera chamaejasme, and Ormocarpum kirkii with data available. A biflavonoid that consists of two units of 5,7,4-trihydroxyflavanone joined together at position 3 and 3.

   

4-Methylisoscutellarein 8-(2-sulfoglucoside)

4-Methylisoscutellarein 8-(2-sulfoglucoside)

C22H22O14S (542.0730232)


   

[(2R,3R,4S)-3,4-dihydroxypyrrolidin-2-yl]methyl-ADP

[(2R,3R,4S)-3,4-dihydroxypyrrolidin-2-yl]methyl-ADP

C15H24N6O12P2 (542.0927404)


   

Plixorafenib

Plixorafenib

C25H21F3N6O3S (542.1347872)


PLX8394 is a potent and selective BRaf inhibitor, with an IC50 of appr 5 nM for BRAFV600E.

   

5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2r,3s)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-8-yl]chromen-4-one

5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2r,3s)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-8-yl]chromen-4-one

C30H22O10 (542.1212912)


   

(1r,5r,13r)-1,9,17,19-tetrahydroxy-5,13-bis(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2,8,10,15,17,19-hexaen-21-one

(1r,5r,13r)-1,9,17,19-tetrahydroxy-5,13-bis(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2,8,10,15,17,19-hexaen-21-one

C30H22O10 (542.1212912)


   

2-[(11s,12r)-8,11-dihydroxy-4,12-bis(4-hydroxyphenyl)-5,13-dioxatricyclo[7.4.0.0²,⁶]trideca-1,3,6,8-tetraene-3-carbonyl]benzene-1,3,5-triol

2-[(11s,12r)-8,11-dihydroxy-4,12-bis(4-hydroxyphenyl)-5,13-dioxatricyclo[7.4.0.0²,⁶]trideca-1,3,6,8-tetraene-3-carbonyl]benzene-1,3,5-triol

C30H22O10 (542.1212912)


   

(2r,3r,4r,5s,6s)-3,5-dihydroxy-2-(hydroxymethyl)-6-(1,3,6,7-tetrahydroxy-9-oxoxanthen-2-yl)oxan-4-yl 4-hydroxybenzoate

(2r,3r,4r,5s,6s)-3,5-dihydroxy-2-(hydroxymethyl)-6-(1,3,6,7-tetrahydroxy-9-oxoxanthen-2-yl)oxan-4-yl 4-hydroxybenzoate

C26H22O13 (542.1060362000001)


   

1,9,17,19-tetrahydroxy-5,13-bis(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2,8,10,15,17,19-hexaen-21-one

1,9,17,19-tetrahydroxy-5,13-bis(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.8.0.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2,8,10,15,17,19-hexaen-21-one

C30H22O10 (542.1212912)


   

(2s,4's,12'r)-4,6,8',11'-tetrahydroxy-4',12'-bis(4-hydroxyphenyl)-5',13'-dioxaspiro[1-benzofuran-2,3'-tricyclo[7.4.0.0²,⁶]tridecane]-1'(9'),2'(6'),7'-trien-3-one

(2s,4's,12'r)-4,6,8',11'-tetrahydroxy-4',12'-bis(4-hydroxyphenyl)-5',13'-dioxaspiro[1-benzofuran-2,3'-tricyclo[7.4.0.0²,⁶]tridecane]-1'(9'),2'(6'),7'-trien-3-one

C30H22O10 (542.1212912)


   

(2s)-6-[(2s)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydro-1-benzopyran-8-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzopyran-4-one

(2s)-6-[(2s)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydro-1-benzopyran-8-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzopyran-4-one

C30H22O10 (542.1212912)


   

(1s,4s,12s,13r)-13,16,18-trihydroxy-4,12-bis(4-hydroxyphenyl)-3,11,21-trioxapentacyclo[11.8.0.0¹,¹⁰.0²,⁷.0¹⁵,²⁰]henicosa-2(7),9,15,17,19-pentaene-8,14-dione

(1s,4s,12s,13r)-13,16,18-trihydroxy-4,12-bis(4-hydroxyphenyl)-3,11,21-trioxapentacyclo[11.8.0.0¹,¹⁰.0²,⁷.0¹⁵,²⁰]henicosa-2(7),9,15,17,19-pentaene-8,14-dione

C30H22O10 (542.1212912)


   

(1s,17r,20r,29s)-5,9,12,20,21,24,29-heptahydroxy-26-methylheptacyclo[15.12.0.0¹,²¹.0³,¹⁶.0⁶,¹⁵.0⁸,¹³.0²³,²⁸]nonacosa-3,5,8,10,12,15,18,23,25,27-decaene-7,14,22-trione

(1s,17r,20r,29s)-5,9,12,20,21,24,29-heptahydroxy-26-methylheptacyclo[15.12.0.0¹,²¹.0³,¹⁶.0⁶,¹⁵.0⁸,¹³.0²³,²⁸]nonacosa-3,5,8,10,12,15,18,23,25,27-decaene-7,14,22-trione

C30H22O10 (542.1212912)


   

(2s,4's,11's,12'r)-4,6,8',11'-tetrahydroxy-4',12'-bis(4-hydroxyphenyl)-5',13'-dioxaspiro[1-benzofuran-2,3'-tricyclo[7.4.0.0²,⁶]tridecane]-1'(9'),2'(6'),7'-trien-3-one

(2s,4's,11's,12'r)-4,6,8',11'-tetrahydroxy-4',12'-bis(4-hydroxyphenyl)-5',13'-dioxaspiro[1-benzofuran-2,3'-tricyclo[7.4.0.0²,⁶]tridecane]-1'(9'),2'(6'),7'-trien-3-one

C30H22O10 (542.1212912)


   

5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-8-yl]chromen-4-one

5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-8-yl]chromen-4-one

C30H22O10 (542.1212912)


   

5,9,12,20,21,24,29-heptahydroxy-26-methylheptacyclo[15.12.0.0¹,²¹.0³,¹⁶.0⁶,¹⁵.0⁸,¹³.0²³,²⁸]nonacosa-3,5,8,10,12,15,18,23,25,27-decaene-7,14,22-trione

5,9,12,20,21,24,29-heptahydroxy-26-methylheptacyclo[15.12.0.0¹,²¹.0³,¹⁶.0⁶,¹⁵.0⁸,¹³.0²³,²⁸]nonacosa-3,5,8,10,12,15,18,23,25,27-decaene-7,14,22-trione

C30H22O10 (542.1212912)


   

(7r,9r,10r,18r,20r,21r)-10,16,21,25-tetrahydroxy-7,9,18,20-tetramethyl-8,11,19,22-tetraoxanonacyclo[15.11.1.1⁶,²⁶.0²,¹⁵.0³,¹².0⁴,²⁷.0⁵,¹⁰.0²¹,²⁹.0²³,²⁸]triaconta-1(29),2(15),3,5,12,16,23,25,27-nonaene-14,30-dione

(7r,9r,10r,18r,20r,21r)-10,16,21,25-tetrahydroxy-7,9,18,20-tetramethyl-8,11,19,22-tetraoxanonacyclo[15.11.1.1⁶,²⁶.0²,¹⁵.0³,¹².0⁴,²⁷.0⁵,¹⁰.0²¹,²⁹.0²³,²⁸]triaconta-1(29),2(15),3,5,12,16,23,25,27-nonaene-14,30-dione

C30H22O10 (542.1212912)