Exact Mass: 452.1601714

Heteroartonin A

2-[2,5-dihydroxy-4-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]-5,7-dihydroxy-3-(3-methylbut-2-en-1-yl)-4H-chromen-4-one

C19H32O8S2 (452.15385119999996)

Heteroartonin A is found in fruits. Heteroartonin A is a constituent of the root bark of Artocarpus heterophyllus (jackfruit). Constituent of the root bark of Artocarpus heterophyllus (jackfruit). Heteroartonin A is found in jackfruit and fruits.

Melleolide M

2a,7-Dihydroxy-3-(hydroxymethyl)-6,6,7b-trimethyl-1H,2H,2ah,4ah,5H,6H,7H,7ah,7BH-cyclobuta[e]inden-2-yl 3-chloro-4,6-dihydroxy-2-methylbenzoic acid

C23H29ClO7 (452.1601714)

Melleolide M is found in mushrooms. Melleolide M is a metabolite of Armillariella mellea (honey mushroom Metabolite of Armillariella mellea (honey mushroom). Melleolide M is found in mushrooms.

5alpha-Androstan-3alpha,17beta-diol disulfate

[(1S,2S,5R,7S,10R,11S,14S,15S)-2,15-dimethyl-5-(sulfooxy)tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]oxidanesulfonic acid

5alpha-Androstan-3alpha,17beta-diol disulfate, also known as 5α-androstan-3α,17β-diol disulfuric acid, is classified as a member of the sulfated steroids. Sulfated steroids are sterol lipids containing a sulfate group attached to the steroid skeleton. 5alpha-Androstan-3alpha,17beta-diol disulfate is considered to be a practically insoluble (in water) and an extremely strong acidic compound. 5alpha-Androstan-3alpha,17beta-diol disulfate can be found in feces.

5alpha-Androstan-3beta,17alpha-diol disulfate

[(1S,2S,5S,7S,10R,11S,14R,15S)-2,15-dimethyl-5-(sulfooxy)tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]oxidanesulfonic acid

C19H32O8S2 (452.15385119999996)

5alpha-Androstan-3beta,17alpha-diol disulfate belongs to the class of organic compounds known as sulfated steroids. These are sterol lipids containing a sulfate group attached to the steroid skeleton. 5alpha-Androstan-3beta,17alpha-diol disulfate was identified as one of forty plasma metabolites that could be used to predict gut microbiome Shannon diversity (PMID: 31477923). Shannon diversity is a metric that summarizes both species abundance and evenness, and it has been suggested as a marker for microbiome health.

Cichorioside J

(1R,8R,9S,13S)-8-hydroxy-12-methylidene-4-(2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl)-2,14-dioxatetracyclo[6.5.2.0¹,⁵.0⁹,¹³]pentadeca-4,6-dien-3-one

Cichorioside j is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Cichorioside j can be found in endive, which makes cichorioside j a potential biomarker for the consumption of this food product.

5-O-Methylvisammioside

(S)-4-Methoxy-7-methyl-2-(2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)propan-2-yl)-2,3-dihydro-5H-furo[3,2-g]chromen-5-one

5-O-Methylvisammioside is a natural product found in Saposhnikovia divaricata with data available. 5-O-Methylvisammioside is a natural product isolated from Saposhnikovia Divaricata. 5-O-Methylvisammioside is a natural product isolated from Saposhnikovia Divaricata.

Skimmin

C24H30O5FCl (452.1765692)

Icariside A4

3,4,5-Trimethoxy-3,4-dithoxybibenzyl 3-O-glucoside

14-Methoxytajixanthone

(14S,15S)-14-Methoxytajixanthone

Artochamin D

Eupalinilide J

Melcanthin C

Chaplashin

[4R-(4R,S,7R,10S)]- 4,6-bis(Acetyloxy)-3-[(acetyloxy)methyl]-5,6,7,8,9,10-hexahydro-7-methoxy-6,10-dimethyl-7,10-epoxycyclodeca[b]furan-2(4H)-one

[4R-(4R*,S*,7R*,10S*)]- 4,6-bis(Acetyloxy)-3-[(acetyloxy)methyl]-5,6,7,8,9,10-hexahydro-7-methoxy-6,10-dimethyl-7,10-epoxycyclodeca[b]furan-2(4H)-one

Okaramine I

Speranculatine B

C20H24N2O10 (452.1430884)

7,8]isoflavone

(+)-5,4-Dihydroxy-6-(3-methylbut-2-enyl)-2-(4-hydroxy-4-methylethyl)-3-methoxydihydrofurano-[4,5

[1aR-(1aR,5R,7S,10aS,10bR*)]-5-(Acetyloxy)-8-[(acetyloxy)methyl]-2,3,6,7,10a,10b-hexahydro-1a,5-dimethyl-7-(1-oxopropoxy)-oxireno[9,10]cyclodeca[1,2-b]furan-4,9(1aH,5H)-dione

[1aR-(1aR*,5R*,7S*,10aS*,10bR*)]-5-(Acetyloxy)-8-[(acetyloxy)methyl]-2,3,6,7,10a,10b-hexahydro-1a,5-dimethyl-7-(1-oxopropoxy)-oxireno[9,10]cyclodeca[1,2-b]furan-4,9(1aH,5H)-dione

Kompasinol A

1,8-Bis(4-hydroxybenzyl)-2,7-dihydroxy-4-methoxyphenanthrene

Erythbigenin

5,7,3,4-Tetrahydroxy-5-methoxy-2,6-diprenylisoflavone

5,7,3,4-Tetrahydroxy-3-methoxy-6-geranylflavone

Artonin S

(+) -6,7-Dihydro-3,9-dihydroxy-6- (1-hydroxy-1-methylethyl) -11-methoxy-10- (3-methyl-2-butenyl) -8H- [ 1 ] benzopyrano [ 3,2-d ] [ 1 ] benzoxepin-8-one

Ligulacephalin B

Khonklonginol C

Atramycin B

Derriflavanone

Glochidacuminoside B

Tetrapterol F

Shanciol A

Epimedokoreanin A

2- (3,4-Dihydro-3,4,8-trihydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl) -8,9-dihydro-5-hydroxy-8- (1-methylethenyl) -4H-furo [ 2,3-h ] -1-benzopyran-4-one

Davisioside

3,4-Dihydroxy-7-methoxy-8-(3-methylbut-2-enyl)-2-(1-hydroxy-1-methylethyl)-furano-(4,5:6,5)favanone

3,4-Dihydroxy-7-methoxy-8- (3-methylbut-2-enyl) -2"- (1-hydroxy-1-methylethyl) -furano- (4",5":6,5) flavanone

Ovatolactone 7-O-(6-O-p-hydroxybenzoyl)-beta-D-glucopyranoside

(-)-Ovatolactone 7-O-(6-O-p-hydroxybenzoyl)-beta-D-glucopyranoside

Erysengalensein C

5,2,4-Trihydroxy-5-methoxy-8-(gamma,gamma-dimethylallyl)-2,2-dimethylpyrano[5,6:6,7]isoflavanone

Lupinol B

(2S,3S)-5,7,4-Trihydroxy-3-methoxy-6,3-diprenylcoumaranochroman-4-one

C26H29ClN2O3 (452.18665940000005)

Ambiguine D isonitrile

sophoronol C

(9R,10S)-rel-(-)-9,10-bis(Acetyloxy)-9,10-dihydro-5-methoxy-8,8-dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b]dipyran-4-one

Dorsmanin D

3,5,7-Trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-bis(3-methyl-2-butenyl)-4H-1-benzopyran-4-one

derrichalcone

5,7-Dihydroxy-8-methoxy-3,4-diprenyloxyflavone

Chamuvaritin

1- [ 1,3-Dihydroxy-4- [ (2-hydroxyphenyl) methyl ] -9H-xanthen-2-yl ] -3-phenyl-1-propanone

CGP 58546

3-Demethoxy-3-hydroxystaurosporine

epi-Derriflavanone

bulgarialactone B

Heteroartonin A

2- [ 2,5-Dihydroxy-4-methoxy-3- (3-methyl-2-butenyl) phenyl ] -5,7-dihydroxy-3- (3-methyl-2-butenyl) -4H-1-benzopyran-4-one

ZINC13465588

C24H24N2O7 (452.1583434)

4-O-beta-D-Glucosyl-5-O-methylvisamminol

8,9-Dihydro-5-hydroxy-8-(1-hydroxy-1-methylethyl)-9-methoxy-6-(3-methyl-1-oxobutyl)-4-phenyl-2H-furo[2,3:5,6]benzo[1,2-b]pyran-2-one|Mammea A/AA methoxycyclo F

C22H28O10

C25H24O8

5-hydroxymorusin|5-hydroxy-8,8-dimethyl-3-(3-methyl-2-butenyl)-2-(2,4,5-trihydroxyphenyl)-4H,8H-benzo(1,2-b:3,4-b)-pyran-4-one|5-hydroxymorusin|artonin E|hydroxyartoflavone A

tschimganic ester A

8alpha-(4-hydroxymethacryloyloxy)-10alpha-hydroxy-1-O-methyl-hirsutinolide-13-O-acetate|8alpha-<4-hydroxymethacryloyloxy>-10alpha-hydroxy-1-O-methyl-hirsutinolide-13-O-acetate

(2S)-2-hydroxy-7-O-methylallopeucenin 2-O-beta-D-glucopyranoside

Anticancer Stilbenolignan PMV70P691-042

8,2-diprenylquercetin 3-methyl ether

C26H28O7

6-(Delta2-isopentenyl)piscerythrone|6-Prenylpiscerythrone|6-prenylpiscerythrone

Carapolide D

8-Propanoyl,1,13-di-Ac-1,4-Epoxy-1,8,10,13-tetrahydroxy-5,7(11)-germacradien-12,6-olide|8-Propanoyl,13-Ac-1,4-Epoxy-1,8,10,13-tetrahydroxy-5,7(11)-germacradien-12,6-olide

SCHEMBL4932182

quassidine B

Skimmin

Chaetoviridin B

C23H29ClO7 (452.1601714)

Broussoflavonol B

5-O-Methyl kushenol C|Kushenol I|Kushenol N

dihydroisoartonin E 2-methylether

artonin V 2-methylether

7-[4-[(2R)-2,3-dihydroxy-3-methylbutoxy]-3-methoxyphenyl]-2,2-dimethylpyrano[3,2-g]chromen-6-one

C19H32O10S (452.17160920000003)

(6R,9R)-9-hydroxymegastigman-4-en-3-one 9-O-beta-D-glucopyranoside 6-O-sulfate|byzantionoside B 6-O-sulfate

notabilisin A

dichamanetin

(2E)-3-[3-(3,4-dihydroxybenzyl)-6-hydroxy-2,4-dimethoxyphenyl]-1-(3-hydroxy-4-methoxyphenyl)prop-2-en-1-one|3,6-dihydroxy-2,4,4-trimethoxy-3-(3,4-dihydroxybenzyl)chalcone

2-(2,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-3-(3-methylbut-2-en-1-yl)-6-(3-methyl-2-oxobutyl)-4H-1-benzopyran-4-one|hypargyflavone B

2,3-epoxykhonklonginol A

5-hydroxyaiphanol|aiphanol

5,5-dimethoxy-3,3-dimethyl[1,1-bi-9H-carbazole]-2,2-diol

C28H24N2O4 (452.1735984)

cnidimoside B

1,5-di-O-Caffeoylquinic acid

dodovicin E

prenyl-urucuol A

artogomezianone

tomentodiplacone I

5,7,3,4-Tetrahydroxy-3-methoxy-8,5-diprenylflavone

metatacarboline E

C23H24N4O6 (452.1695764)

5,7,3,4-Tetrahydroxy-3-methoxy-8-geranylflavone

N-demethylstaurosporine

Artocommunol CC

SCHEMBL19665263

macaranone B

A tetrahydroxyflavone that is flavonol substituted by additional hydroxy groups at positions 5, 7 and 3, a methoxy group at position 4 and a geranyl group at position 2. It has been isolated from the twigs of Morus nigra.

12-Acetyl-13,21-dihydroeurycomanone

Isochamuvaritin

A member of the class of a xanthenes that is 9H-xanthene substituted by hydroxy groups at positions 1 and 3, a 2-hydroxybenzyl group at position 2 and a 3-phenylpropanoyl group at position 4. Isolated from the roots of Uvaria acuminata, it exhibits potent cytotoxicity against human promyelocytic leukemia HL-60 cells.

trichirubine A

NSC231829

9-(1-Hydroperoxy-isopropyl)-6,12-dihydroxy-3,3-dimethyl-8H,9H-benzo[f]pyrano[6,5-8,7]chromeno[3,2-d]oxepin-7-one

1alpha-acetoxy-2beta,3alpha,6beta,7beta,12beta-pentahydroxy-7,20;19,20-diepoxy-ent-kaur-16-en-15-one|taibaijaponicain D

5-Methoxy-(3,4-dihydro-3,4-diacetoxy)-2,2-dimethylpyrano-(7,8:5,6)-flavone

8alpha-(4-hydroxytigloyloxy)-10alpha-hydroxyhirsutinolide-13-O-acetate|8alpha-<4-hydroxytigloyloxy>-10alpha-hydroxyhirsutinolide-13-O-acetate

Erysenegalensein C

IAA-Asp-N-Glc

C20H24N2O10 (452.1430884)

(E)-1-(glutathion-S-yl)-N-hydroxy-omega-(methylsulfanyl)pentan-1-imine

Methylkushenol C

methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate

NCGC00380341-01!methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate

methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate [IIN-based on: CCMSLIB00000846691]

NCGC00380341-01!methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate [IIN-based on: CCMSLIB00000846691]

methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate [IIN-based: Match]

NCGC00380341-01!methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate [IIN-based: Match]

Ala Cys Glu Met

(4S)-4-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

Ala Cys Met Glu

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C20H28N4O6S (452.17294680000003)

Ala Cys Pro Tyr

(2S)-2-{[(2S)-1-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-(4-hydroxyphenyl)propanoic acid

Ala Cys Tyr Pro

(2S)-1-[(2S)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid

C20H28N4O6S (452.17294680000003)

Ala Glu Cys Met

(4S)-4-[(2S)-2-aminopropanamido]-4-{[(1R)-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid

Ala Glu Met Cys

(4S)-4-[(2S)-2-aminopropanamido]-4-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

Ala Met Cys Glu

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]pentanedioic acid

Ala Met Glu Cys

(4S)-4-[(2S)-2-[(2S)-2-aminopropanamido]-4-(methylsulfanyl)butanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid