Exact Mass: 552.2029

Chenodeoxycholic acid disulfate

C24H40O10S2 (552.2063)

Chenodeoxycholic acid disulfate is a bile acid derviative. A bile acid. Bile acids are steroid acids found predominantly in the bile of mammals. The distinction between different bile acids is minute, depending only on the presence or absence of hydroxyl groups on positions 3, 7, and 12. Bile acids are physiological detergents that facilitate excretion, absorption, and transport of fats and sterols in the intestine and liver. Bile acids are also steroidal amphipathic molecules derived from the catabolism of cholesterol. They modulate bile flow and lipid secretion, are essential for the absorption of dietary fats and vitamins, and have been implicated in the regulation of all the key enzymes involved in cholesterol homeostasis. Bile acids recirculate through the liver, bile ducts, small intestine and portal vein to form an enterohepatic circuit. They exist as anions at physiological pH and, consequently, require a carrier for transport across the membranes of the enterohepatic tissues. The unique detergent properties of bile acids are essential for the digestion and intestinal absorption of hydrophobic nutrients. Bile acids have potent toxic properties (e.g. membrane disruption) and there are a plethora of mechanisms to limit their accumulation in blood and tissues (PMID: 11316487, 16037564, 12576301, 11907135). A bile acid derviative. A bile acid. Bile acids are steroid acids found predominantly in bile of mammals. The distinction between different bile acids is minute, depends only on presence or absence of hydroxyl groups on positions 3, 7, and 12.

Deoxycholic acid disulfate

C24H40O10S2 (552.2063)

Deoxycholic acid disulfate is a substrate for Proteinase activated receptor 2, Heterogeneous nuclear ribonucleoprotein H, Small inducible cytokine A24 and Hemoglobin alpha chain. [HMDB] Deoxycholic acid disulfate is a substrate for Proteinase activated receptor 2, Heterogeneous nuclear ribonucleoprotein H, Small inducible cytokine A24 and Hemoglobin alpha chain.

Arctignan B

C30H32O10 (552.1995)

Arctignan b is a member of the class of compounds known as dibenzylbutyrolactone lignans. Dibenzylbutyrolactone lignans are lignan compounds containing a 3,4-dibenzyloxolan-2-one moiety. Arctignan b is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Arctignan b can be found in burdock, which makes arctignan b a potential biomarker for the consumption of this food product.

Arctignan C

C30H32O10 (552.1995)

Arctignan c is a member of the class of compounds known as dibenzylbutyrolactone lignans. Dibenzylbutyrolactone lignans are lignan compounds containing a 3,4-dibenzyloxolan-2-one moiety. Arctignan c is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Arctignan c can be found in burdock, which makes arctignan c a potential biomarker for the consumption of this food product.

O(C)c1c(OC)cc2c3c1c1c(c(-c4c5nccc6c5c(C(=O)C(OC)=C6)c5c4cccc5)c3N(C)CC2)cccc1

C36H28N2O4 (552.2049)

Thielavin P

C30H32O10 (552.1995)

Thielavin G

C30H32O10 (552.1995)

Thielavin F

C30H32O10 (552.1995)

Thielavin E

C30H32O10 (552.1995)

MCULE-3282147030

C30H32O10 (552.1995)

C30H32O10

C30H32O10 (552.1995)

arctignan B

C30H32O10 (552.1995)

haterumalide B

C28H37ClO9 (552.2126)

7-hydroxyisolappalol A

C30H32O10 (552.1995)

1-(3-Methoxy-4-hydroxyphenyl)-2-[2-hydroxy-3-methoxy-5-[4-(3-methoxy-4-hydroxyphenyl)-3,7-dioxabicyclo[3.3.0]octane-8-yl]phenyl]-3-hydroxy-1-propanone

C30H32O10 (552.1995)

Dumosaol

C30H32O10 (552.1995)

arctignan C

C30H32O10 (552.1995)

(6-O-beta-D-glucopyranosyl)-6alpha-dihydrocornic acid methyl ester

C23H36O15 (552.2054)

Thielavin K

C30H32O10 (552.1995)

NCGC00347745-02!

C30H32O10 (552.1995)

6,18-bis(1-hydroxy-3-methylbut-2-en-1-yl)-11,22-dimethyl-5,10,17,21-tetraoxaheptacyclo[11.7.2.0²,⁸.0²,¹².0⁴,⁶.0¹⁴,²⁰.0¹⁶,¹⁸]docosa-8,14(20)-diene-3,7,15,19-tetrone

C30H32O10 (552.1995)

[IIN-based on: CCMSLIB00000845479]

C30H32O10 (552.1995)

[IIN-based: Match]

C30H32O10 (552.1995)

(4R)-4-((3R,5S,7R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7-bis(sulfooxy)hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid

C24H40O10S2 (552.2063)

Glu Glu Glu Phe

C24H32N4O11 (552.2067)

Glu Glu Phe Glu

C24H32N4O11 (552.2067)

Glu Phe Glu Glu

C24H32N4O11 (552.2067)

Glu His His Met

C22H32N8O7S (552.2115)

Glu His Met His

C22H32N8O7S (552.2115)

Glu Met His His

C22H32N8O7S (552.2115)

Phe Glu Glu Glu

C24H32N4O11 (552.2067)

His Glu His Met

C22H32N8O7S (552.2115)

His Glu Met His

C22H32N8O7S (552.2115)

His His Glu Met

C22H32N8O7S (552.2115)

His His Met Glu

C22H32N8O7S (552.2115)

His Met Glu His

C22H32N8O7S (552.2115)

His Met His Glu

C22H32N8O7S (552.2115)

Met Glu His His

C22H32N8O7S (552.2115)

Met His Glu His

C22H32N8O7S (552.2115)

Met His His Glu

C22H32N8O7S (552.2115)

Chenodeoxycholic acid disulfate

C24H40O10S2 (552.2063)

Deoxycholic acid disulfate

C24H40O10S2 (552.2063)

1a,8a-bis(1-hydroxy-3-methylbut-2-en-1-yl)-5,13-dimethyl-1a,5,5a,6,7a,8a,10,11a-octahydro-10,6-(epoxymethano)oxireno[2,3:4,5]benzo[1,2-d]oxireno[2,3:4,5]benzo[1,2-g]isochromene-2,7,9,11-tetraone

C30H32O10 (552.1995)

Ribostamycin sulfate

C17H36N4O14S (552.1949)

Ribostamycin sulfate (Vistamycin sulfate) is a broad-spectrum antimicrobial, inhibits bacterial protein synthesis at the level of 30S and 50S ribosomal subunit binding, also inhibits the chaperone activity of protein disulfide isomerase (PDI), used in pharmacokinetic and nephrotoxicity studies

4-(n-ethyl-n-2-methoxyethyl)-2-methylphenylenediamine di-p-toluenesulfonate

C26H36N2O7S2 (552.1964)

Lufotrelvir

C24H33N4O9P (552.1985)

COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C254 - Anti-Infective Agent > C281 - Antiviral Agent C471 - Enzyme Inhibitor > C783 - Protease Inhibitor Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

6,18-Bis(1-hydroxy-3-methylbut-2-enyl)-11,22-dimethyl-5,10,17,21-tetraoxaheptacyclo[11.7.2.02,8.02,12.04,6.014,20.016,18]docosa-8,14(20)-diene-3,7,15,19-tetrone

C30H32O10 (552.1995)

3-Diphenylphosphoryl-7-(diphenylphosphorylmethyl)-6-methyl-4-oxatricyclo[4.3.0.03,7]nonane

C34H34O3P2 (552.1983)

N-[(2S,3S)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-pyridinecarboxamide

C28H32N4O6S (552.2042)

2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(2-phenylethyl)acetamide

C29H32N2O7S (552.193)

N-[[(4R,5S)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-phenyl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide

C29H32N2O7S (552.193)

N-[[(4R,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-phenyl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide

C29H32N2O7S (552.193)

N-[[(4S,5S)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-phenyl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide

C29H32N2O7S (552.193)

N-[[(4R,5R)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-phenyl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide

C29H32N2O7S (552.193)

N-[[(4S,5S)-8-(1-cyclohexenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide

C25H36N4O6S2 (552.2076)

N-[[(4S,5S)-8-(1-cyclohexenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide

C25H36N4O6S2 (552.2076)

N-[[(4S,5R)-8-(1-cyclohexenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide

C25H36N4O6S2 (552.2076)

N-[[(4R,5R)-8-(1-cyclohexenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide

C25H36N4O6S2 (552.2076)

N-[[(4S,5R)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-phenyl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide

C29H32N2O7S (552.193)

N-[[(4R,5R)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-phenyl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide

C29H32N2O7S (552.193)

N-[[(4S,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-phenyl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide

C29H32N2O7S (552.193)

N-[[(4S,5R)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-phenyl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide

C29H32N2O7S (552.193)

N-[[(4S,5R)-8-(1-cyclohexenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide

C25H36N4O6S2 (552.2076)

N-[[(4R,5S)-8-(1-cyclohexenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide

C25H36N4O6S2 (552.2076)

N-[[(4R,5R)-8-(1-cyclohexenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide

C25H36N4O6S2 (552.2076)

N-[[(4R,5S)-8-(1-cyclohexenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide

C25H36N4O6S2 (552.2076)

2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(2-phenylethyl)acetamide

C29H32N2O7S (552.193)

2-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(2-phenylethyl)acetamide

C29H32N2O7S (552.193)

2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(2-phenylethyl)acetamide

C29H32N2O7S (552.193)

N-[(2S,3S)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-pyridinecarboxamide

C28H32N4O6S (552.2042)

2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(2-phenylethyl)acetamide

C29H32N2O7S (552.193)

2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(2-phenylethyl)acetamide

C29H32N2O7S (552.193)

2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(2-phenylethyl)acetamide

C29H32N2O7S (552.193)

N-[(2S,3R)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-pyridinecarboxamide

C28H32N4O6S (552.2042)

N-[(2R,3R)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-pyridinecarboxamide

C28H32N4O6S (552.2042)

N-[(2R,3R)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-pyridinecarboxamide

C28H32N4O6S (552.2042)

N-[(2R,3S)-2-[[benzenesulfonyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-pyridinecarboxamide

C28H32N4O6S (552.2042)

2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(2-phenylethyl)acetamide

C29H32N2O7S (552.193)

ST 27:6;O7;S

C27H36O10S (552.2029)

[4-hydroxy-2-(2-methoxyphenoxy)-4-(2-methoxyphenoxymethyl)oxolan-3-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C30H32O10 (552.1995)

4-[4-(2,4-dihydroxy-3,6-dimethylbenzoyloxy)-2-methoxy-3,5,6-trimethylbenzoyloxy]-2-methoxy-3,6-dimethylbenzoic acid

C30H32O10 (552.1995)

4-[4-(2,4-dihydroxy-6-propylbenzoyloxy)-2-hydroxy-6-propylbenzoyloxy]-2-hydroxy-6-propylbenzoic acid

C30H32O10 (552.1995)

(3r,4r)-4-({4-hydroxy-3-[(2s)-3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-1-oxopropan-2-yl]-5-methoxyphenyl}methyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one

C30H32O10 (552.1995)

arctignan c

C30H32O10 (552.1995)

{"Ingredient_id": "HBIN016614","Ingredient_name": "arctignan c","Alias": "NA","Ingredient_formula": "C30H32O10","Ingredient_Smile": "COC1=CC(=CC(=C1O)C(CO)C(=O)C2=CC(=C(C=C2)O)OC)CC3C(COC3=O)CC4=CC(=C(C=C4)O)OC","Ingredient_weight": "552.57","OB_score": "NA","CAS_id": "155661-10-2","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6704","PubChem_id": "73425487","DrugBank_id": "NA"}

4-[4-(2,4-dihydroxy-3,6-dimethylbenzoyloxy)-6-methoxy-2,3-dimethylbenzoyloxy]-2-methoxy-3,5,6-trimethylbenzoic acid

C30H32O10 (552.1995)

4-[4-(2,4-dihydroxy-3,6-dimethylbenzoyloxy)-2-methoxy-3,5,6-trimethylbenzoyloxy]-6-methoxy-2,3-dimethylbenzoic acid

C30H32O10 (552.1995)

4-[4-(2,4-dihydroxy-3,5,6-trimethylbenzoyloxy)-2-hydroxy-3,5,6-trimethylbenzoyloxy]-2-hydroxy-3,5,6-trimethylbenzoic acid

C30H32O10 (552.1995)

methyl 5-hydroxy-7-methyl-1-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-carboxylate

C23H36O15 (552.2054)

methyl (1r,4as,5s,7s,7ar)-5-hydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-carboxylate

C23H36O15 (552.2054)

5-[2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]-4-(hydroxymethyl)oxolan-2-one

C30H32O10 (552.1995)

2-methylidene-3-oxobutyl (3e,5r)-5-[(1r,5r,6e,9z,13r,15r)-5-(acetyloxy)-10-chloro-6-methyl-3-oxo-2,14-dioxabicyclo[11.2.1]hexadeca-6,9-dien-15-yl]-5-hydroxy-3-methylpent-3-enoate

C28H37ClO9 (552.2126)

4-[4-(2,4-dihydroxy-3,6-dimethylbenzoyloxy)-2-methoxy-3,5,6-trimethylbenzoyloxy]-2-hydroxy-3,5,6-trimethylbenzoic acid

C30H32O10 (552.1995)

(2z,4r,8s,9r,11r)-13-[(3-acetyl-2,6-dihydroxy-5-methylphenyl)methyl]-2-(hydroxymethyl)-11-methyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradeca-1(13),2-dien-9-yl (2z)-2-methylbut-2-enoate

C30H32O10 (552.1995)

4-[4-(2,4-dihydroxy-6-methylbenzoyloxy)-2-methoxy-3,5,6-trimethylbenzoyloxy]-2-methoxy-3,5,6-trimethylbenzoic acid

C30H32O10 (552.1995)

(3r,4r)-3-({4-hydroxy-3-[(2s)-3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-1-oxopropan-2-yl]-5-methoxyphenyl}methyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one

C30H32O10 (552.1995)

8-{15,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2(7),3,5,8,13,15-heptaen-8-yl}-15-methoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,8,10,12,14-octaen-16-one

C36H28N2O4 (552.2049)

13-[(3-acetyl-2,6-dihydroxy-5-methylphenyl)methyl]-2-(hydroxymethyl)-11-methyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradeca-1(13),2-dien-9-yl 2-methylbut-2-enoate

C30H32O10 (552.1995)

[(2s,3s,4r)-4-hydroxy-2-(2-methoxyphenoxy)-4-(2-methoxyphenoxymethyl)oxolan-3-yl]methyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C30H32O10 (552.1995)