Exact Mass: 398.1372322
Exact Mass Matches: 398.1372322
Found 500 metabolites which its exact mass value is equals to given mass value 398.1372322
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
AdoMet
[Spectral] S-Adenosyl-L-methionine (exact mass = 398.13724) and L-Histidine (exact mass = 155.06948) were not completely separated on HPLC under the present analytical conditions as described in AC$XXX. Additionally some of the peaks in this data contains dimers and other unidentified ions. A - Alimentary tract and metabolism > A16 - Other alimentary tract and metabolism products > A16A - Other alimentary tract and metabolism products > A16AA - Amino acids and derivatives Acquisition and generation of the data is financially supported in part by CREST/JST. C26170 - Protective Agent > C275 - Antioxidant COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
S-adenosyl-4-methylthio-2-oxobutanoate
C15H20N5O6S+ (398.11342400000007)
S-adenosyl-4-methylthio-2-oxobutanoic acid is a member of the class of compounds known as 5-deoxy-5-thionucleosides. 5-deoxy-5-thionucleosides are 5-deoxyribonucleosides in which the ribose is thio-substituted at the 5position by a S-alkyl group. S-adenosyl-4-methylthio-2-oxobutanoic acid is practically insoluble (in water) and a moderately acidic compound (based on its pKa). S-adenosyl-4-methylthio-2-oxobutanoic acid can be found in a number of food items such as hard wheat, chinese cabbage, cauliflower, and kai-lan, which makes S-adenosyl-4-methylthio-2-oxobutanoic acid a potential biomarker for the consumption of these food products. S-adenosyl-4-methylthio-2-oxobutanoic acid exists in E.coli (prokaryote) and yeast (eukaryote).
Acroptilin
A sesquiterpene lactone that is isolated from Acroptilon repens and displays anti-allergic properties.
Anthricin
D000890 - Anti-Infective Agents > D000998 - Antiviral Agents D007155 - Immunologic Factors > D018796 - Immunoconjugates D007155 - Immunologic Factors > D007136 - Immunoglobulins D007155 - Immunologic Factors > D000906 - Antibodies D009676 - Noxae > D000922 - Immunotoxins Deoxypodophyllotoxin (DPT), a derivative of podophyllotoxin, is a lignan with potent antimitotic, anti-inflammatory and antiviral properties isolated from Anthriscus sylvestris. Deoxypodophyllotoxin, targets the microtubule, has a major impact in oncology not only as anti-mitotics but also as potent inhibitors of angiogenesis[1]. Deoxypodophyllotoxin induces cell autophagy and apoptosis[2]. Deoxypodophyllotoxin evokes increase of intracellular Ca2+ concentrations in DRG neurons[3]. Deoxypodophyllotoxin (DPT), a derivative of podophyllotoxin, is a lignan with potent antimitotic, anti-inflammatory and antiviral properties isolated from Anthriscus sylvestris. Deoxypodophyllotoxin, targets the microtubule, has a major impact in oncology not only as anti-mitotics but also as potent inhibitors of angiogenesis[1]. Deoxypodophyllotoxin induces cell autophagy and apoptosis[2]. Deoxypodophyllotoxin evokes increase of intracellular Ca2+ concentrations in DRG neurons[3].
Taraxacoside
Constituent of Taraxacum officinale (dandelion). Taraxacoside is found in many foods, some of which are coffee and coffee products, alcoholic beverages, tea, and dandelion. Taraxacoside is found in alcoholic beverages. Taraxacoside is a constituent of Taraxacum officinale (dandelion)
Dulxanthone E
Dulxanthone E is found in fruits. Dulxanthone E is a constituent of Garcinia dulcis (mundu). Constituent of Garcinia dulcis (mundu). Dulxanthone E is found in fruits.
5'-Methoxycurcumin
Constituent of Curcuma xanthorrhiza (Java turmeric). 5-Methoxycurcumin is found in herbs and spices, beverages, and root vegetables. 5-Methoxycurcumin is found in beverages. 5-Methoxycurcumin is a constituent of Curcuma xanthorrhiza (Java turmeric).
Picraquassioside A
Picraquassioside A is found in herbs and spices. Picraquassioside A is a constituent of Ruta graveolens (rue). Constituent of Ruta graveolens (rue). Picraquassioside A is found in herbs and spices.
Methyl (3x,10R)-dihydroxy-11-dodecene-6,8-diynoate 10-glucoside
Methyl (3x,10R)-dihydroxy-11-dodecene-6,8-diynoate 10-glucoside is found in root vegetables. Methyl (3x,10R)-dihydroxy-11-dodecene-6,8-diynoate 10-glucoside is a constituent of Helianthus tuberosus (Jerusalem artichoke). Constituent of Helianthus tuberosus (Jerusalem artichoke). Methyl (3x,10R)-dihydroxy-11-dodecene-6,8-diynoate 10-glucoside is found in root vegetables.
5-(3',4'-dihydroxyphenyl)-gamma-valerolactone-3'-O-glucuronide
5-(3,4-dihydroxyphenyl)-gamma-valerolactone glucuronide is a cocoa metabolite from gut microflora. It is found in urine.
N-Feruloylglycyl-L-phenylalanine
N-Feruloylglycyl-L-phenylalanine is found in pulses. N-Feruloylglycyl-L-phenylalanine is a constituent of Medicago sativa (alfalfa)
Methyl acrylate-divinylbenzene, completely hydrolyzed, copolymer
Methyl acrylate-dvb(2\\%), copolymer, aminolyzed with dmapa is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") It is used as a food additive .
Methyl 3,4-dihydroxy-5-prenylbenzoate 3-glucoside
Methyl 3,4-dihydroxy-5-prenylbenzoate 3-glucoside is found in pomes. Methyl 3,4-dihydroxy-5-prenylbenzoate 3-glucoside is a constituent of apple leaves (Malus domestica). Constituent of apple leaves (Malus domestica). Methyl 3,4-dihydroxy-5-prenylbenzoate 3-glucoside is found in pomes.
5-(3',4'-Dihydroxyphenyl)-gamma-valerolactone-3'-O-methyl-4'-O-glucuronide
5-(3,4-Dihydroxyphenyl)-gamma-valerolactone-3-O-methyl-4-O-glucuronide is a conjugate of 5-(3,4-dihydroxyphenyl)-gamma-valerolactone-3-O-methyl and glucuronide. A glucuronide, also known as glucuronoside, is any substance produced by linking glucuronic acid to another substance via a glycosidic bond. The glucuronides belong to the glycosides. (Wikipedia)
5-(3',4'-Dihydroxyphenyl)-gamma-valerolactone-4'-O-methyl-3'-O-glucuronide
5-(3,4-Dihydroxyphenyl)-gamma-valerolactone-4-O-methyl-3-O-glucuronide is a conjugate of 5-(3,4-dihydroxyphenyl)-gamma-valerolactone-4-O-methyl and glucuronide. A glucuronide, also known as glucuronoside, is any substance produced by linking glucuronic acid to another substance via a glycosidic bond. The glucuronides belong to the glycosides. (Wikipedia)
5-(3',5'-Dihydroxyphenyl)-gamma-valerolactone-O-glucuronide-O-methyl
5-(3,5-Dihydroxyphenyl)-gamma-valerolactone-O-glucuronide-O-methyl belongs to the family of Mixed Pentose/Hexose Disaccharides. These are disaccharides containing both an hexose and a pentose.
(-)-Deoxypodophyllotoxin
D000890 - Anti-Infective Agents > D000998 - Antiviral Agents D007155 - Immunologic Factors > D018796 - Immunoconjugates D007155 - Immunologic Factors > D007136 - Immunoglobulins D007155 - Immunologic Factors > D000906 - Antibodies D009676 - Noxae > D000922 - Immunotoxins
Camostat
COVID info from Guide to PHARMACOLOGY, clinicaltrial, clinicaltrials, clinical trial, clinical trials, COVID-19 Disease Map B - Blood and blood forming organs > B02 - Antihemorrhagics > B02A - Antifibrinolytics > B02AB - Proteinase inhibitors D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D015842 - Serine Proteinase Inhibitors C471 - Enzyme Inhibitor > C783 - Protease Inhibitor Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Finafloxacin
Fursultiamine
Idalopirdine
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists C78272 - Agent Affecting Nervous System > C66885 - Serotonin Antagonist
Darolutamide
C19H19ClN6O2 (398.12579439999996)
Omarigliptin
C17H20F2N4O3S (398.12241140000003)
(2S)-2-[[(2R,3S,4R,5R)-5-(6-Aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylamino]-4-methylsulfanylbutanoic acid
1-[[(2S,3S,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-2-yl]methoxy]propan-2-one
C15H26O12 (398.14241960000004)
5-Sinapoylquinic acid
5-sinapoylquinic acid belongs to quinic acids and derivatives class of compounds. Those are compounds containing a quinic acid moiety (or a derivative thereof), which is a cyclitol made up of a cyclohexane ring that bears four hydroxyl groups at positions 1,3.4, and 5, as well as a carboxylic acid at position 1. 5-sinapoylquinic acid is slightly soluble (in water) and a weakly acidic compound (based on its pKa). 5-sinapoylquinic acid can be found in a number of food items such as apple, european plum, sour cherry, and pear, which makes 5-sinapoylquinic acid a potential biomarker for the consumption of these food products.
4-Sinapoylquinic acid
4-sinapoylquinic acid belongs to quinic acids and derivatives class of compounds. Those are compounds containing a quinic acid moiety (or a derivative thereof), which is a cyclitol made up of a cyclohexane ring that bears four hydroxyl groups at positions 1,3.4, and 5, as well as a carboxylic acid at position 1. 4-sinapoylquinic acid is slightly soluble (in water) and a weakly acidic compound (based on its pKa). 4-sinapoylquinic acid can be found in a number of food items such as apricot, peach (variety), sweet cherry, and pear, which makes 4-sinapoylquinic acid a potential biomarker for the consumption of these food products.
3-Sinapoylquinic acid
3-sinapoylquinic acid belongs to quinic acids and derivatives class of compounds. Those are compounds containing a quinic acid moiety (or a derivative thereof), which is a cyclitol made up of a cyclohexane ring that bears four hydroxyl groups at positions 1,3.4, and 5, as well as a carboxylic acid at position 1. 3-sinapoylquinic acid is slightly soluble (in water) and a weakly acidic compound (based on its pKa). 3-sinapoylquinic acid can be found in a number of food items such as sour cherry, sweet cherry, european plum, and peach (variety), which makes 3-sinapoylquinic acid a potential biomarker for the consumption of these food products. .
1S-Hydroxy-1,2-dihydrosphaerococcenol A
C20H31BrO3 (398.14564359999997)
(3alpha,4beta,7alpha,8alpha)-12,13-Epoxytrichothec-9-ene-3,4,7,8,15-pentol 4,15-diacetate
Cnidioside B
NCGC00384499-01_C18H22O10_5-Benzofuranpropanoic acid, 6-(beta-D-glucopyranosyloxy)-7-methoxy- is a natural product found in Picrasma quassioides, Ruta graveolens, and Ammi majus with data available.
6-Prenylherbacetin 3,8-dimethyl ether
6-Prenylquercetin 3-methyl ether
Artoindonesianin Q
Artoindonesianin R
5,7-Dihydroxy-3-methoxy-2-[3-methoxy-4-[(3-methyl-2-butenyl)oxy]phenyl]-4H-1-benzopyran-4-one
5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxy-7-[(3-methyl-2-butenyl)oxy]-4H-1-benzopyran-4-one
4-amino-3-(1-(4-fluorobenzyl)-1H-indazole-3-carboxamido)-2-methyl-4-oxobutanoicacid
5-Demethoxy-beta-peltatin-A-methylaether|5-demethoxy-beta-peltatin-A-methylether|5-desmethoxy-beta-peltatin A methyl ether
3-acetoxymethyl-5-((E)-2-formylethen-1-yl)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-2,3-dihydrobenzofuran
(3R,5S,6S,8S,9S,10R,13R)-3-bromo-6-hydroxy-8,13-epoxylabd-14-en-1-one
C20H31BrO3 (398.14564359999997)
8,9-dihydro-3,5,7-trihydroxy-1,8,8,9-tetramethyl-5-(2-oxopropyl)-4h-phenaleno[1,2-b]furan-4,6(5h)-dione
6-carboxyethyl-7-methoxy-5-hydroxybenzofuran 5-O-beta-D-glucopyranoside|Picraquassioside A
5,7-dihydroxy-6-methyl-4-phenyl-8-(3-phenyl-trans-acryloyl)-1-benzopyran-2-one|interruptin B
14R-hydroxy-13,14-dihydro-sphaerococcenol A|14R-hydroxy-13,14-dihydro-sphaerococcenol-A
C20H31BrO3 (398.14564359999997)
6,13-dihydro-dibenzo[b,i]phenazine-5,12-dicarboxylic acid dimethyl ester|Caulerpin
Me ester,tri-Me ether-1,6,8-Trihydroxy-3-propylanthraquinone-2-carboxylic acid
6,8-dihydroxy-5-methoxy-3-methylisocoumarin 6-O-(4-O-methyl-beta-D-glucopyranoside)
3-ethyl-6-(4-O-methyl-beta-D-glucopyranosyloxy)-8-hydroxy-7-methyl-3,4-dihydroisocoumarin
3R-(+)-5-O-[6-O-acetyl]-alpha-D-glucopyranosyl-5-hydroxymellein
9-(benzo[d][1,3]dioxol-5-yl)-6,7,8-trimethoxy-3a,4,9,9a-tetrahydronaphtho[2,3-c]furan-1(3h)-one
(S)-3,5-dihydroxy-2,7-dimethoxy-2,2-dimethylpyrano[5,6:3,4]isoflavanone|sophoronol-7-methyl ether
(+)-(1S,3R,4R,5R,6S,7R,8S)-3-chloro-1,4-dihydroxy-8-isovaleryloxyguai-9,11(13)-dien-6,12-olide|argyinolide C
C20H27ClO6 (398.14960720000005)
5-hydroxy-3,7-dimethoxy-4-(1-hydroxy-3-methylbut-3-en-2-yloxy)-flavone
(+)-(1S,3R,4R,5R,6S,7R,8S)-3-chloro-1,4-dihydroxy-8-(2-xi-methylbutyryloxy)guai-9,11(13)-dien-6,12-olide|argyinolide D
C20H27ClO6 (398.14960720000005)
desacyl-11,13-dihydrochlorojanerin 8-O-angelate
C20H27ClO6 (398.14960720000005)
Schisandrin C epoxide
OC1=C(C(=CC=2C(C3=CC(=CC(=C3C(C1=2)=O)OC)OC)=O)O)C1OC(CCC1)C
15-bromo-2,7,16-trihydroxy-9(11)-parguerene
C20H31BrO3 (398.14564359999997)
(7S,8R,8R)-9-O-acetyldihydrosesamin|Dihydrosesamin acetate
SchisantherinR
AS 2-3
Deoxypodophyllotoxin is a member of the class of furonaphthodioxoles that is (5R,5aR,8aR)-5,8,8a,9-tetrahydro-2H-furo[3,4:6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one substituted at position 5 by a 3,4,5-trimethoxyphenyl group. It has a role as a plant metabolite, an antineoplastic agent and an apoptosis inducer. It is a lignan, a furonaphthodioxole, a gamma-lactone and a member of methoxybenzenes. Deoxypodophyllotoxin is a natural product found in Austrocedrus chilensis, Libocedrus bidwillii, and other organisms with data available. A member of the class of furonaphthodioxoles that is (5R,5aR,8aR)-5,8,8a,9-tetrahydro-2H-furo[3,4:6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one substituted at position 5 by a 3,4,5-trimethoxyphenyl group. D000890 - Anti-Infective Agents > D000998 - Antiviral Agents D007155 - Immunologic Factors > D018796 - Immunoconjugates D007155 - Immunologic Factors > D007136 - Immunoglobulins D007155 - Immunologic Factors > D000906 - Antibodies D009676 - Noxae > D000922 - Immunotoxins Deoxypodophyllotoxin (DPT), a derivative of podophyllotoxin, is a lignan with potent antimitotic, anti-inflammatory and antiviral properties isolated from Anthriscus sylvestris. Deoxypodophyllotoxin, targets the microtubule, has a major impact in oncology not only as anti-mitotics but also as potent inhibitors of angiogenesis[1]. Deoxypodophyllotoxin induces cell autophagy and apoptosis[2]. Deoxypodophyllotoxin evokes increase of intracellular Ca2+ concentrations in DRG neurons[3]. Deoxypodophyllotoxin (DPT), a derivative of podophyllotoxin, is a lignan with potent antimitotic, anti-inflammatory and antiviral properties isolated from Anthriscus sylvestris. Deoxypodophyllotoxin, targets the microtubule, has a major impact in oncology not only as anti-mitotics but also as potent inhibitors of angiogenesis[1]. Deoxypodophyllotoxin induces cell autophagy and apoptosis[2]. Deoxypodophyllotoxin evokes increase of intracellular Ca2+ concentrations in DRG neurons[3].
isoanthricin
Ademetionine
A - Alimentary tract and metabolism > A16 - Other alimentary tract and metabolism products > A16A - Other alimentary tract and metabolism products > A16AA - Amino acids and derivatives A sulfonium betaine that is a conjugate base of S-adenosyl-L-methionine obtained by the deprotonation of the carboxy group. C26170 - Protective Agent > C275 - Antioxidant COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Physiologic methyl radical donor involved in enzymatic transmethylation reactions and present in all living organisms. It possesses anti-inflammatory activity and has been used in treatment of chronic liver disease. (From Merck, 11th ed) [HMDB]
2-(4,5-dihydroxy-7,7a-dimethyl-2-oxo-5,6,7,7b-tetrahydro-4H-naphtho[1,2-b]oxiren-1a-yl)prop-2-enyl 2,3,4-trihydroxybutanoate
(5-benzoyloxy-4,6-dihydroxy-3-methoxycyclohexen-1-yl)methyl benzoate
[2-hydroxy-3-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxypropyl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
C18H22O10_5-Benzofuranpropanoic acid, 4-(beta-D-glucopyranosyloxy)-6-methoxy
C18H22O10_5-Benzofuranpropanoic acid, 6-(beta-D-glucopyranosyloxy)-7-methoxy
(5-benzoyloxy-4,6-dihydroxy-3-methoxycyclohexen-1-yl)methyl benzoate
(5-benzoyloxy-4,6-dihydroxy-3-methoxycyclohexen-1-yl)methyl benzoate [IIN-based on: CCMSLIB00000848473]
[2-hydroxy-3-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxypropyl] (E)-3-(4-hydroxyphenyl)prop-2-enoate [IIN-based on: CCMSLIB00000848893]
[2-hydroxy-3-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxypropyl] (E)-3-(4-hydroxyphenyl)prop-2-enoate [IIN-based on: CCMSLIB00000848892]
[2-hydroxy-3-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxypropyl] (E)-3-(4-hydroxyphenyl)prop-2-enoate [IIN-based: Match]
(5-benzoyloxy-4,6-dihydroxy-3-methoxycyclohexen-1-yl)methyl benzoate [IIN-based: Match]
(5-benzoyloxy-4,6-dihydroxy-3-methoxycyclohexen-1-yl)methyl benzoate_major
S-Adenosylmethionine
S-Adenosyl-DL-methionine is a derivative of Ademetionine (HY-B0617). Ademetionine is an intermediate metabolite of methionine[1].
Ala Asp Gly His
Ala Asp His Gly
Ala Gly Asp His
Ala Gly His Asp
Ala His Asp Gly
Ala His Gly Asp
Cys Gly Gly Tyr
Cys Gly Tyr Gly
Cys Tyr Gly Gly
Asp Ala Gly His
Asp Ala His Gly
Asp Gly Ala His
Asp Gly His Ala
Asp His Ala Gly
Asp His Gly Ala
Glu Gly Gly His
Glu Gly His Gly
Glu His Gly Gly
Gly Ala Asp His
Gly Ala His Asp
Gly Cys Gly Tyr
Gly Cys Tyr Gly
Gly Asp Ala His
Gly Asp His Ala
Gly Glu Gly His
Gly Glu His Gly
Gly Gly Cys Tyr
Gly Gly Glu His
Gly Gly His Glu
Gly Gly Tyr Cys
Gly His Ala Asp
Gly His Asp Ala
Gly His Glu Gly
Gly His Gly Glu
Gly Tyr Cys Gly
Gly Tyr Gly Cys
His Ala Asp Gly
His Ala Gly Asp
His Asp Ala Gly
His Asp Gly Ala
His Glu Gly Gly
His Gly Ala Asp
His Gly Asp Ala
His Gly Glu Gly
His Gly Gly Glu
Tyr Cys Gly Gly
Tyr Gly Cys Gly
Tyr Gly Gly Cys
D 4476
C23H18N4O3 (398.13788379999994)
5-(3,4-dihydroxyphenyl)-gamma-valerolactone glucuronide
N-Feruloylglycyl-L-phenylalanine
Taraxacoside
Methyl acrylate-divinylbenzene, completely hydrolyzed, copolymer
Methyl 3,4-dihydroxy-5-prenylbenzoate 3-glucoside
Methyl (3x,10R)-dihydroxy-11-dodecene-6,8-diynoate 10-glucoside
Picraquassioside A
Thiourea, N-[2-(1H-benzimidazol-2-yl)ethyl]-N-(2-chlorophenyl)-N-cyclopentyl- (9CI)
C21H23ClN4S (398.13318680000003)
(E)-1,4,5,6-tetrahydro-1-methyl-2-[2-(2-thienyl)vinyl]pyrimidine citrate (1:1)
Finafloxacin
A quinolone that is 4-oxo-1,4-dihydroquinoline-3-carboxylic acid which is substituted at positions 1, 6, 7 and 8 by cyclopropyl, fluoro, hexahydropyrrolo[3,4-b][1,4]oxazin-6-yl and cyano groups respectively; an antibiotic used for treatment of acute otitis externa (swimmers ear) caused by the bacteria Pseudomonas aeruginosa and Staphylococcus aureus. D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059005 - Topoisomerase II Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D024841 - Fluoroquinolones C254 - Anti-Infective Agent > C258 - Antibiotic > C795 - Quinolone Antibiotic D004791 - Enzyme Inhibitors
2-METHOXY-4-(2-NITROVINYL)PHENYL-2-ACETAMIDO-2-DEOXY-BETA-GLUCOPYRANOSIDE
C17H22N2O9 (398.13252420000003)
Safinamide Mesylate
C78272 - Agent Affecting Nervous System > C264 - Anticonvulsant Agent C471 - Enzyme Inhibitor > C667 - Monoamine Oxidase Inhibitor
1-Tosyl-1H-Pyrrolo[2,3-b]pyridine-4-boronic acid pinacol ester
Omarigliptin
C17H20F2N4O3S (398.12241140000003)
C78276 - Agent Affecting Digestive System or Metabolism > C29711 - Anti-diabetic Agent > C98086 - Dipeptidyl Peptidase-4 Inhibitor C471 - Enzyme Inhibitor > C783 - Protease Inhibitor
1-(benzenesulfonyl)-2-methyl-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine
3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1-TOSYL-1H-PYRROLO[2,3-B]PYRIDINE
Methanone, (3,5-dimethyl-4-isoxazolyl)[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-
(Z)-4-(benzo[d][1,3]dioxol-5-ylmethyl)-3-(3,4,5-triMethoxybenzylidene)dihydrofuran-2(3H)-one
5-ACETAMIDO-2-ACETOXY-4-DIMETHYLAMINO-2-METHOXYCARBONYL-BENZOPHENONE
3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1-tosyl-1H-pyrrolo[2,3-c]pyridine
4-acetamido-2-acetoxy-4-dimethylamino-2-methoxycarbonyl-benzophenone
(2,6-Dimethoxy-[1,1-biphenyl]-2-yl)diphenylphosphine
Benzo1,2-b:4,5-bdifuran-2,6-dione, 3-phenyl-7-(4-propoxyphenyl)-
Thiourea, N-[2-(1H-benzimidazol-2-yl)ethyl]-N-(4-chlorophenyl)-N-cyclopentyl- (9CI)
C21H23ClN4S (398.13318680000003)
Thiourea, N-[2-(1H-benzimidazol-2-yl)ethyl]-N-(3-chlorophenyl)-N-cyclopentyl- (9CI)
C21H23ClN4S (398.13318680000003)
1,5-divinyl-3,3-diphenyl-1,1,5,5-tetramethyltrisiloxane
ODM-201
C19H19ClN6O2 (398.12579439999996)
L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02B - Hormone antagonists and related agents > L02BB - Anti-androgens C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C146993 - Androgen Receptor Inhibitor C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist > C242 - Anti-Androgen
(R)-2-[4-(2-fluorobenzyloxy)benzylamino]propanamide methanesulfonate
C17H19FN2O2.CH4O3S (398.131164)
Guanidine, (4-pyridylmethyl)-, sulfate (2:1) (8CI)
C14H22N8O4S (398.14846520000003)
8-(4-ethoxyphenyl)-2-methyl-4,7-dioxo-5-phenyl-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile
C23H18N4O3 (398.13788379999994)
1,2-bis-(Benzyloxycarbonyl)piperazine-3-carboxylic acid
1-(2,3,4,6-TETRA-O-ACETYL-B-D-GLUCOPYRANOSYL)IMIDAZOLE
C17H22N2O9 (398.13252420000003)
(S)-1-(1-(4-Chloro-2-methoxyphenyl)-5-fluoro-1,9-dihydrospiro[cyclopropane-1,4-pyrido[3,4-b]indol]-2(3H)-yl)ethan-1-one
N-({4-[(2-aminopyridin-4-yl)oxy]-3-fluorophenyl}carbamoyl)-2-(4-fluorophenyl)acetamide
C20H16F2N4O3 (398.1190409999999)
5,7,3-Trihydroxy-3,5-dimethoxy-2-(3-methylbut-2-enyl)flavone
A trihydroxyflavone that is flavone substituted by hydroxy groups at positions 5, 7 and 3, methoxy groups at positions 3 and 5 and a prenyl group at position 2. Isolated from Tabernaemontana macrocarpa, it exhibits inhibitory activity against breast cancer resistance protein.
Ethyl 3-({[(benzyloxy)imino]methyl}amino)-4-(dimethylamino)thieno[2,3-b]pyridine-2-carboxylate
C20H22N4O3S (398.14125420000005)
4-Amino-2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]-5-pyrimidinecarboxylic acid ethyl ester
7-(2,5-Dimethoxyphenyl)-5-(trifluoromethyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester
1-((2-Hydroxyethoxy)methyl)-5-(3-(benzyloxy)benzyl)-6-hydroxypyrimidine-2,4(1H,3H)-dione
3,3-[3,5-Difluoro-4-methyl-2,6-pyridylenebis(oxy)]-bis(benzenecarboximidamide)
C20H18F2N5O2+ (398.14284919999994)
Camostat
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Idalopirdine
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S-Adenosyl-DL-methionine
S-Adenosyl-DL-methionine is a derivative of Ademetionine (HY-B0617). Ademetionine is an intermediate metabolite of methionine[1].
5-(3',4'-dihydroxyphenyl)-gamma-valerolactone-3'-O-glucuronide
5-(3,4-dihydroxyphenyl)-gamma-valerolactone glucuronide is a cocoa metabolite from gut microflora. It is found in urine.
3-O-sinapoylquinic acid
A cinnamate ester obtained by formal condensation of the carboxy group of sinapic acid with the 3-hydroxy group of (-)-quinic acid.
(2S)-2-[[(2R,3S,4R,5R)-5-(6-Aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methylamino]-4-methylsulfanylbutanoic acid
1-[[(2S,3S,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxolan-2-yl]methoxy]propan-2-one
C15H26O12 (398.14241960000004)
2-[(2-propyl-4-quinazolinyl)thio]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
[4-(2-Methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-piperazinyl]-thiophen-2-ylmethanone
4-(1-Naphthylmethoxy)benzaldehyde (5-nitro-2-pyridinyl)hydrazone
C23H18N4O3 (398.13788379999994)
4-[[Oxo-(1-phenyl-3-pyridin-4-yl-4-pyrazolyl)methyl]amino]benzoic acid methyl ester
C23H18N4O3 (398.13788379999994)
4-(1H-indol-3-yl)butanoic acid [2-(4-amino-1,3-dimethyl-2,6-dioxo-5-pyrimidinyl)-2-oxoethyl] ester
4-(4-hydroxy-3-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (4-methoxyphenyl)methyl ester
7-(2,3-Dimethoxyphenyl)-5-(trifluoromethyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester
N-[2-(4-chlorophenyl)ethyl]-2-[ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide
N-(2-hydroxy-5-nitrobenzylidene)-1-(4-methoxyphenyl)-5-oxo-3-pyrrolidinecarbohydrazide
C19H18N4O6 (398.12262880000003)
(-)-6,8-Dihydroxy-5-methoxy-3-methylisocoumarin 6-O-(4-O-methyl-beta-D-glucopyranoside)
A natural product found in Conoideocrella tenuis.
methyl 3-(4-chlorophenyl)-3-{[N-(isopropoxycarbonyl)valyl]amino}propanoate
4-[3-(3-dioxaziridinyl)phenyl]-5-(3-hydroxy-1-oxopropyl)-2,6-dimethyl-1-prop-2-ynyl-4H-pyridine-3-carboxylic acid methyl ester
2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[[oxo(3-pyridinyl)methyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
(5Z,11R)-3-[(4-chlorophenyl)methyl]-11-phenyl-1-oxa-3,10-diazacyclododec-5-ene-2,9-dione
2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(1-oxo-2-pyridin-4-ylethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
2-(4,5-dihydroxy-7,7a-dimethyl-2-oxo-5,6,7,7b-tetrahydro-4H-naphtho[1,2-b]oxiren-1a-yl)prop-2-enyl 2,3,4-trihydroxybutanoate
2-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-6-[[oxo(3-pyridinyl)methyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
2-[(1S,3S,4aS,9aR)-6-[[anilino(oxo)methyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
2-[(1R,3S,4aS,9aR)-6-[[anilino(oxo)methyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
C18H26N2O6S (398.15114960000005)
2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
C18H26N2O6S (398.15114960000005)
2-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
C18H26N2O6S (398.15114960000005)
2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
C18H26N2O6S (398.15114960000005)
2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(1-oxo-2-pyridin-4-ylethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[[oxo(3-pyridinyl)methyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-[[oxo(3-pyridinyl)methyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[[oxo(3-pyridinyl)methyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-[[oxo(3-pyridinyl)methyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
2-[(1R,3R,4aR,9aS)-6-[[anilino(oxo)methyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
2-[(1S,3R,4aS,9aR)-6-[[anilino(oxo)methyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
2-[(1R,3R,4aS,9aR)-6-[[anilino(oxo)methyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
2-[(1S,3S,4aR,9aS)-6-[[anilino(oxo)methyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
2-[(1S,3R,4aR,9aS)-6-[[anilino(oxo)methyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid
2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
C18H26N2O6S (398.15114960000005)
2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
C18H26N2O6S (398.15114960000005)
2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
C18H26N2O6S (398.15114960000005)
2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-(methanesulfonamido)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
C18H26N2O6S (398.15114960000005)
3,4,5-Trihydroxy-6-[5-(4-methoxyphenyl)-2-methyl-3-oxopentoxy]oxane-2-carboxylic acid
3,4,5-Trihydroxy-6-[5-(4-methoxyphenyl)-2-methyl-3-oxopentan-2-yl]oxyoxane-2-carboxylic acid
3,4,5-Trihydroxy-6-[1-(4-methoxyphenyl)-4-methyl-3-oxopentoxy]oxane-2-carboxylic acid
3,4,5-Trihydroxy-6-[1-(4-methoxyphenyl)-4-methyl-3-oxopentan-2-yl]oxyoxane-2-carboxylic acid
[2-hydroxy-3-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxypropyl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
S-adenosyl-4-methylthio-2-oxobutanoate
C15H20N5O6S+ (398.11342400000007)
5-(3,4-dihydroxyphenyl)-gamma-valerolactone-3-O-glucuronide
4-methoxy-N-(2-{[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)benzohydrazide
5-(3,5-Dihydroxyphenyl)-gamma-valerolactone-O-glucuronide-O-methyl
5-(3,4-Dihydroxyphenyl)-gamma-valerolactone-4-O-methyl-3-O-glucuronide
5-(3,4-Dihydroxyphenyl)-gamma-valerolactone-3-O-methyl-4-O-glucuronide
4-O-sinapoylquinic acid
A cinnamate ester obtained by formal condensation of the carboxy group of sinapic acid with the 4-hydroxy group of (-)-quinic acid.
5-O-sinapoylquinic acid
A cinnamate ester obtained by formal condensation of the carboxy group of sinapic acid with the 5-hydroxy group of (-)-quinic acid.
S-Adenosyl-4-methylthio-2-oxobutanoic acid
C15H20N5O6S (398.11342400000007)
A sulfonium compound comprising 4-methylthio-2-oxobutanoic acid having an adenosin-5-yl group attached to the sulfur.
(1s,6r,9r,12r,13r,14r,15r,16s)-15-chloro-13,14-dihydroxy-6-[(2r)-1-hydroxypropan-2-yl]-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-2,7-diene-4,11-dione
(3ar,4s,6ar,8s,9s,9as,9bs)-8-hydroxy-3,6-dimethylidene-2-oxo-octahydrospiro[azuleno[4,5-b]furan-9,2'-oxiran]-4-yl (2r)-3-chloro-2-hydroxy-2-methylpropanoate
3-oxo-3-{[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(5-isopropyl-2-methylphenoxy)oxan-2-yl]methoxy}propanoic acid
(1r,4s,5s,6s)-5-[(benzoyloxy)methyl]-5,6-dihydroxy-4-methoxycyclohex-2-en-1-yl benzoate
(10r,11s,15s)-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one
16-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one
5,7-dihydroxy-6-methyl-4-phenyl-8-(3-phenylprop-2-enoyl)chromen-2-one
3-(4-methoxy-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1-benzofuran-5-yl)propanoic acid
(7s,8s,9r)-9-(2h-1,3-benzodioxol-5-yl)-9-hydroxy-7,8-dimethyl-2h,6h,7h,8h-naphtho[1,2-d][1,3]dioxol-6-yl acetate
{3,4,5-trihydroxy-6-[(8-hydroxy-3-methyl-1-oxo-3,4-dihydro-2-benzopyran-5-yl)oxy]oxan-2-yl}methyl acetate
15-chloro-8,13,14-trihydroxy-6-isopropyl-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-2,6-diene-4,11-dione
2,13-dimethyl 11,22-diazapentacyclo[13.7.0.0⁴,¹².0⁵,¹⁰.0¹⁶,²¹]docosa-1,3,5,7,9,12,14,16,18,20-decaene-2,13-dicarboxylate
(3ar,4s,6ar,8s,9s,9as,9bs)-9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl (2s)-2-methyloxirane-2-carboxylate
3-({[(2s,3s,4r,5r,6s)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}methyl)-8-hydroxy-6-methoxyisochromen-1-one
(3ar,4s,6ar,8s,9r,9as,9bs)-8-hydroxy-3,6-dimethylidene-2-oxo-octahydrospiro[azuleno[4,5-b]furan-9,2'-oxiran]-4-yl (2s)-3-chloro-2-hydroxy-2-methylpropanoate
[(2s,3r,4r)-2-(2h-1,3-benzodioxol-5-yl)-4-(2h-1,3-benzodioxol-5-ylmethyl)oxolan-3-yl]methyl acetate
(2's,5's,6as,7s,8s,10as)-5'-(furan-3-yl)-8-methyl-3,9-dioxo-1,6a,8,10-tetrahydrospiro[naphtho[4,4a-c]furan-7,3'-oxolan]-2'-yl acetate
(1r,10s,12r,13r,16s,17r)-18-(acetyloxy)-13-carboxy-14-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraene-8,15-diium-8,15-bis(olate)
(1r)-5,7'-dihydroxy-10'-methoxy-2,3-dihydrospiro[indene-1,3'-phenanthro[2,1-b]furan]-2'-one
6-(4,5-dihydroxy-6-methyloxan-2-yl)-5-hydroxy-7-methoxy-2-phenylchromen-4-one
9-(chloromethyl)-7,8,9-trihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl 2-methylprop-2-enoate
(2r,3s,4r,5r,6r)-4,5-dihydroxy-2-(hydroxymethyl)-6-{[(3r)-5-oxooxolan-3-yl]oxy}oxan-3-yl 2-(4-hydroxyphenyl)acetate
(10r,15r)-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one
(1r,10s,13r,14s,15s,16s,17s,18r)-18-(acetyloxy)-13-carboxy-14-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraene-8,15-diium-8,15-bis(olate)
8a-(bromomethyl)-4,5-dihydroxy-8-isopropyl-4,10a-dimethyl-4a,4b,5,6,7,8,9,10-octahydrophenanthren-3-one
C20H31BrO3 (398.14564359999997)
anhydropodorhizol
{"Ingredient_id": "HBIN016173","Ingredient_name": "anhydropodorhizol","Alias": "NA","Ingredient_formula": "C22H22O7","Ingredient_Smile": "COC1=CC(=CC(=C1OC)OC)C=C2C(COC2=O)CC3=CC4=C(C=C3)OCO4","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1280","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
anthricin
{"Ingredient_id": "HBIN016299","Ingredient_name": "anthricin","Alias": "NA","Ingredient_formula": "C22H22O7","Ingredient_Smile": "COC1=CC(=CC(=C1OC)OC)C2C3C(CC4=CC5=C(C=C24)OCO5)COC3=O","Ingredient_weight": "398.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1372","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "71045228","DrugBank_id": "NA"}
anthricin isomer
{"Ingredient_id": "HBIN016300","Ingredient_name": "anthricin isomer","Alias": "NA","Ingredient_formula": "C22H22O7","Ingredient_Smile": "COC1=CC(=CC(=C1OC)OC)C2C3C(CC4=CC5=C(C=C24)OCO5)COC3=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1373","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3s,9r)-13-chloro-9,14-dihydroxy-16-methoxy-3-methyl-3,4,5,7,8,9,10,12-octahydro-2-benzoxacyclotetradecine-1,6,11-trione
(3ar,4s,6ar,7s,8s,9s,9as,9br)-9-(chloromethyl)-7,8,9-trihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl 2-methylprop-2-enoate
5,7-dihydroxy-3-[3-(3-hydroxy-3-methylbut-1-en-1-yl)-4,5-dimethoxyphenyl]chromen-4-one
9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl 2-methyloxirane-2-carboxylate
9-(2h-1,3-benzodioxol-5-yl)-9-hydroxy-7,8-dimethyl-2h,6h,7h,8h-naphtho[1,2-d][1,3]dioxol-6-yl acetate
4,8-dihydroxy-6-methoxy-3-(2,3,8-trihydroxy-4-oxononyl)-3,4-dihydro-2-benzopyran-1-one
6-{[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}-8-hydroxy-5-methoxy-3-methylisochromen-1-one
7,8-dimethoxy-3,4-dihydro-3',10'-dioxaspiro[1,5-benzodioxepine-2,4'-tricyclo[7.3.0.0²,⁶]dodecane]-1',6',8',11'-tetraen-5'-one; ethane
9-(chloromethyl)-8,9-dihydroxy-3-methyl-6-methylidene-2-oxo-octahydro-3h-azuleno[4,5-b]furan-4-yl 2-methylbut-2-enoate
C20H27ClO6 (398.14960720000005)
(10r,11s,15r)-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one
3-oxo-3-{[3,4,5-trihydroxy-6-(5-isopropyl-2-methylphenoxy)oxan-2-yl]methoxy}propanoic acid
4-(2h-1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methylidene]oxolan-2-one
(1'r,2s,2's,4s,6's,7'r,8'r,10's,12'r,13's)-1',7',13'-trihydroxy-4-(1-hydroxyethyl)-5',5',12'-trimethyl-4',9'-dioxaspiro[oxolane-2,11'-tetracyclo[8.2.1.0²,⁶.0⁸,¹²]tridecane]-3',5-dione
(3ar,4s,6ar,8s,9s,9as,9bs)-9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl (2r)-2-methyloxirane-2-carboxylate
7-{[(2s)-3,3-dimethyloxiran-2-yl]methoxy}-5-hydroxy-3,8-dimethoxy-2-phenylchromen-4-one
[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-{[(3r)-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-2-benzopyran-5-yl]oxy}oxan-2-yl]methyl acetate
3-(7-methoxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1-benzofuran-5-yl)propanoic acid
1-(4-hydroxy-3,5-dimethoxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione
[2-(2h-1,3-benzodioxol-5-yl)-4-(2h-1,3-benzodioxol-5-ylmethyl)oxolan-3-yl]methyl acetate
(3r,3ar,4s,6ar,8s,9s,9as,9bs)-9-(chloromethyl)-8,9-dihydroxy-3-methyl-6-methylidene-2-oxo-octahydro-3h-azuleno[4,5-b]furan-4-yl (2z)-2-methylbut-2-enoate
C20H27ClO6 (398.14960720000005)
5,7-dihydroxy-6-methyl-4-phenyl-8-[(2e)-3-phenylprop-2-enoyl]chromen-2-one
methyl (3r,10r)-3-hydroxy-10-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}dodec-11-en-6,8-diynoate
(4s,4ar,4bs,5s,8s,8as,10ar)-8a-(bromomethyl)-4,5-dihydroxy-8-isopropyl-4,10a-dimethyl-4a,4b,5,6,7,8,9,10-octahydrophenanthren-3-one
C20H31BrO3 (398.14564359999997)
methyl 4-(3-acetyl-2,6-dihydroxyphenyl)-2-methoxy-4-(3-methoxy-2-methyl-3-oxopropoxy)butanoate
(10r,11r)-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one
(3s,4r)-4,8-dihydroxy-6-methoxy-3-[(2s,3s,8s)-2,3,8-trihydroxy-4-oxononyl]-3,4-dihydro-2-benzopyran-1-one
(10s,11s,15r)-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one
(3s,7r,8s,9s)-13-chloro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-3,4,7,8,9,10-hexahydro-2-benzoxacyclotetradecin-1-one
7-{[(2r)-3,3-dimethyloxiran-2-yl]methoxy}-5-hydroxy-3,8-dimethoxy-2-phenylchromen-4-one
(3s,4r)-4,8-dihydroxy-6-methoxy-3-[(2s,3s,4s,5e,8s)-2,3,4,8-tetrahydroxynon-5-en-1-yl]-3,4-dihydro-2-benzopyran-1-one
5,7-dihydroxy-3-{3-[(1e)-3-hydroxy-3-methylbut-1-en-1-yl]-4,5-dimethoxyphenyl}chromen-4-one
13-chloro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-3,4,7,8,9,10-hexahydro-2-benzoxacyclotetradecin-1-one
(1ar,1br,3r,3ar,5s,7br,9r,9ar)-5-[(1s)-1-bromo-2-hydroxyethyl]-1a,5,7b-trimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthrene-3,9-diol
C20H31BrO3 (398.14564359999997)
(2r)-2-amino-4-[(s)-{[(2s,3r,4s,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl}(methyl)sulfaniumyl]butanoate
(1s,21s,24s)-9,12-dimethoxy-24-methyl-5,7,14,16,23-pentaoxahexacyclo[19.2.1.0²,¹⁰.0⁴,⁸.0¹¹,¹⁹.0¹³,¹⁷]tetracosa-2(10),3,8,11(19),12,17-hexaene
1',7',13'-trihydroxy-4-(1-hydroxyethyl)-5',5',12'-trimethyl-4',9'-dioxaspiro[oxolane-2,11'-tetracyclo[8.2.1.0²,⁶.0⁸,¹²]tridecane]-3',5-dione
5-[(benzoyloxy)methyl]-5,6-dihydroxy-4-methoxycyclohex-2-en-1-yl benzoate
(3s,3's,4s,6s,6's,7r)-3'-(acetyloxy)-6,7-dihydroxy-6',7-dimethyl-8-oxo-1,4,5,6-tetrahydrospiro[2-benzopyran-3,2'-oxan]-4-yl acetate
(1r,2r,4r,7r,10r)-7-(furan-3-yl)-9-methyl-5,15-dioxo-6,16-dioxatetracyclo[8.7.0.0¹,¹⁴.0⁴,⁸]heptadeca-8,13-dien-2-yl acetate
(6s)-6-({6-[2-(dimethylamino)ethyl]-2h-1,3-benzodioxol-5-yl}methyl)-2h-[1,3]dioxolo[4,5-e]isoindole-6,8-diol
9,12-dimethoxy-21,22-dimethyl-5,7,14,16,23-pentaoxahexacyclo[18.2.1.0²,¹⁰.0⁴,⁸.0¹¹,¹⁹.0¹³,¹⁷]tricosa-2(10),3,8,11(19),12,17-hexaene
5,7-dihydroxy-2-(4-hydroxyphenyl)-3,8-dimethoxy-6-(3-methylbut-2-en-1-yl)chromen-4-one
6-({6-[2-(dimethylamino)ethyl]-2h-1,3-benzodioxol-5-yl}methyl)-2h-[1,3]dioxolo[4,5-e]isoindole-6,8-diol
3-({[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}methyl)-8-hydroxy-6-methoxyisochromen-1-one
(1r,4s,4as,4bs,8s,8as,10as)-8a-(bromomethyl)-1,4-dihydroxy-8-isopropyl-4,10a-dimethyl-1,2,4a,4b,7,8,9,10-octahydrophenanthren-3-one
C20H31BrO3 (398.14564359999997)
5-{[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}-8-hydroxy-6-methoxy-3-methylisochromen-1-one
3-(7-methoxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1-benzofuran-6-yl)propanoic acid
3-{2,5-dimethoxy-4-[(3-methylbut-2-en-1-yl)oxy]phenyl}-5,7-dihydroxychromen-4-one
2-(5,6-dimethoxy-1-benzofuran-2-yl)-6,7-dimethoxy-2-methyl-3h-1-benzopyran-4-one
(3z,4r)-4-(2h-1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methylidene]oxolan-2-one
3-{[(2s,4r,5s,6r)-4,5-dihydroxy-6-methyloxan-2-yl]oxy}-1-ethyl-8-hydroxyanthracene-9,10-dione
8a-(bromomethyl)-1,4-dihydroxy-8-isopropyl-4,10a-dimethyl-1,2,4a,4b,7,8,9,10-octahydrophenanthren-3-one
C20H31BrO3 (398.14564359999997)
5-methyl-11-{pyrido[3,4-b]indol-9-yl}indolo[3,2-b]quinoline
6-[(2r,4s,5s,6r)-4,5-dihydroxy-6-methyloxan-2-yl]-5-hydroxy-7-methoxy-2-phenylchromen-4-one
3-{2,5-dimethoxy-3-[(3-methylbut-2-en-1-yl)oxy]phenyl}-5,7-dihydroxychromen-4-one
(1r,10s,13r,14s,16s)-18-(acetyloxy)-13-carboxy-14-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraene-8,15-diium-8,15-bis(olate)
9,12-dimethoxy-24-methyl-5,7,14,16,23-pentaoxahexacyclo[19.2.1.0²,¹⁰.0⁴,⁸.0¹¹,¹⁹.0¹³,¹⁷]tetracosa-2(10),3,8,11(19),12,17-hexaene
5-(1-bromo-2-hydroxyethyl)-1a,5,7b-trimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthrene-3,9-diol
C20H31BrO3 (398.14564359999997)
7-(furan-3-yl)-9-methyl-5,15-dioxo-6,16-dioxatetracyclo[8.7.0.0¹,¹⁴.0⁴,⁸]heptadeca-8,13-dien-2-yl acetate
(1ar,1br,3r,3ar,5s,7br,9r,9ar)-5-[(1r)-1-bromo-2-hydroxyethyl]-1a,5,7b-trimethyl-1h,1bh,2h,3h,3ah,4h,6h,8h,9h,9ah-cyclopropa[a]phenanthrene-3,9-diol
C20H31BrO3 (398.14564359999997)
5'-(furan-3-yl)-8-methyl-3,9-dioxo-1,6a,8,10-tetrahydrospiro[naphtho[4,4a-c]furan-7,3'-oxolan]-2'-yl acetate
5,7'-dihydroxy-10'-methoxy-2,3-dihydrospiro[indene-1,3'-phenanthro[2,1-b]furan]-2'-one
(4s,5r)-5-[2-(2h-1,3-benzodioxol-5-yl)-3,4,5-trimethoxyphenyl]-4-methyl-3-methylideneoxolan-2-one
(3e,4r)-4-(2h-1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methylidene]oxolan-2-one
8-hydroxy-3,6-dimethylidene-2-oxo-octahydrospiro[azuleno[4,5-b]furan-9,2'-oxiran]-4-yl 3-chloro-2-hydroxy-2-methylpropanoate
7-[(3,3-dimethyloxiran-2-yl)methoxy]-5-hydroxy-3,8-dimethoxy-2-phenylchromen-4-one
(3ar,4s,6ar,7r,8s,9s,9as,9br)-9-(chloromethyl)-7,8,9-trihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl 2-methylprop-2-enoate
(2'r,5's,6ar,7s,8s,10as)-5'-(furan-3-yl)-8-methyl-3,9-dioxo-1,6a,8,10-tetrahydrospiro[naphtho[4,4a-c]furan-7,3'-oxolan]-2'-yl acetate
(3s)-7-hydroxy-5-methoxy-3-[(1r,3s,4s,5r,6e,9s)-1,3,4,5,9-pentahydroxydec-6-en-1-yl]-3h-2-benzofuran-1-one
(2r)-2-(5,6-dimethoxy-1-benzofuran-2-yl)-6,7-dimethoxy-2-methyl-3h-1-benzopyran-4-one
(4s,4as,4bs,5s,8s,8as,10ar)-8a-(bromomethyl)-4,5-dihydroxy-8-isopropyl-4,10a-dimethyl-4a,4b,5,6,7,8,9,10-octahydrophenanthren-3-one
C20H31BrO3 (398.14564359999997)
5,7-dihydroxy-3-methoxy-2-{3-methoxy-4-[(3-methylbut-2-en-1-yl)oxy]phenyl}chromen-4-one
(2r,3r,4s,5s,6r)-4,5-dihydroxy-2-{[(2e)-4-hydroxy-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxan-3-yl 2-(4-hydroxyphenyl)acetate
(3ar,4s,6ar,7r,8s,9s,9as,9bs)-9-(chloromethyl)-7,8,9-trihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl 2-methylprop-2-enoate
2,5-bis(1h-indol-3-yl)-3,6-dimethoxycyclohexa-2,5-diene-1,4-dione
(3s,4r)-3-[(2s,3s)-2,3-dihydroxy-3-[(2s,6s)-2-hydroxy-6-methyloxan-2-yl]propyl]-4,8-dihydroxy-6-methoxy-3,4-dihydro-2-benzopyran-1-one
3-[2,3-dihydroxy-3-(2-hydroxy-6-methyloxan-2-yl)propyl]-4,8-dihydroxy-6-methoxy-3,4-dihydro-2-benzopyran-1-one
(1'r,2s,2's,4s,6's,7'r,8's,10's,12'r,13's)-1',7',13'-trihydroxy-4-[(1s)-1-hydroxyethyl]-5',5',12'-trimethyl-4',9'-dioxaspiro[oxolane-2,11'-tetracyclo[8.2.1.0²,⁶.0⁸,¹²]tridecane]-3',5-dione
2,4-dihydroxy-3,6-dimethoxy-5-(3-phenylprop-2-enoyl)phenyl 2-methylbut-2-enoate
(2r,4r,7r,10r)-7-(furan-3-yl)-9-methyl-5,15-dioxo-6,16-dioxatetracyclo[8.7.0.0¹,¹⁴.0⁴,⁸]heptadeca-8,13-dien-2-yl acetate
(1r,20s,21r,22s)-9,12-dimethoxy-21,22-dimethyl-5,7,14,16,23-pentaoxahexacyclo[18.2.1.0²,¹⁰.0⁴,⁸.0¹¹,¹⁹.0¹³,¹⁷]tricosa-2(10),3,8,11(19),12,17-hexaene
(10s,11r,15r)-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one
2,13-dimethyl (14z)-11,22-diazapentacyclo[13.7.0.0⁴,¹².0⁵,¹⁰.0¹⁶,²¹]docosa-1,3,5,7,9,12,14,16,18,20-decaene-2,13-dicarboxylate
4,8-dihydroxy-6-methoxy-3-(2,3,4,8-tetrahydroxynon-5-en-1-yl)-3,4-dihydro-2-benzopyran-1-one
3-(4-methoxy-6-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1-benzofuran-5-yl)propanoic acid
(7s)-7-methyl-6,8-dioxo-3-propylisochromen-7-yl 4-hydroxy-2-methoxy-6-methylbenzoate
2-(3,4-dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-6-(3-methylbut-2-en-1-yl)chromen-4-one
3-(7-methoxy-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1-benzofuran-5-yl)propanoic acid
(3s)-7-hydroxy-5-methoxy-3-[(1r,3s,4s,5s,6e,9s)-1,3,4,5,9-pentahydroxydec-6-en-1-yl]-3h-2-benzofuran-1-one
4-hydroxy-2-(4-hydroxy-2-methoxyphenyl)-5-(2-hydroxy-3-methylbut-3-en-1-yl)-6-methoxy-1-benzofuran-3-carbaldehyde
2-({4-[(2,5-dihydroxyphenyl)methyl]-2,5-dihydroxyphenyl}methyl)-6-(methoxymethyl)benzene-1,4-diol
5-{[(2r,3s,4r,5r,6s)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}-8-hydroxy-6-methoxy-3-methylisochromen-1-one
5,7-dihydroxy-3,8-dimethoxy-2-{4-[(3-methylbut-2-en-1-yl)oxy]phenyl}chromen-4-one
(2r)-2-amino-4-({[(2s,3r,4s,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl}(methyl)sulfaniumyl)butanoate
(1r,20s,21s,22r)-9,12-dimethoxy-21,22-dimethyl-5,7,14,16,23-pentaoxahexacyclo[18.2.1.0²,¹⁰.0⁴,⁸.0¹¹,¹⁹.0¹³,¹⁷]tricosa-2(10),3,8,11(19),12,17-hexaene
2,4-dihydroxy-3,6-dimethoxy-5-[(2e)-3-phenylprop-2-enoyl]phenyl (2z)-2-methylbut-2-enoate
7-methyl-6,8-dioxo-3-propylisochromen-7-yl 4-hydroxy-2-methoxy-6-methylbenzoate
5,7-dihydroxy-3,6-dimethoxy-2-{4-[(3-methylbut-2-en-1-yl)oxy]phenyl}chromen-4-one
(11r,15s,16r)-16-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one
(1r,21r,24r)-9,12-dimethoxy-24-methyl-5,7,14,16,23-pentaoxahexacyclo[19.2.1.0²,¹⁰.0⁴,⁸.0¹¹,¹⁹.0¹³,¹⁷]tetracosa-2(10),3,8,11(19),12,17-hexaene
5,12-dimethyl 6,13-dihydro-6,13-diazapentacene-5,12-dicarboxylate
3-(7-methoxy-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1-benzofuran-6-yl)propanoic acid
7-hydroxy-5-methoxy-3-(1,3,4,5,9-pentahydroxydec-6-en-1-yl)-3h-2-benzofuran-1-one
6-{[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}-8-hydroxy-5-methoxy-3-methylisochromen-1-one
3'-(acetyloxy)-6,7-dihydroxy-6',7-dimethyl-8-oxo-1,4,5,6-tetrahydrospiro[2-benzopyran-3,2'-oxan]-4-yl acetate
4-hydroxy-2-(4-hydroxy-2-methoxyphenyl)-5-[(2r)-2-hydroxy-3-methylbut-3-en-1-yl]-6-methoxy-1-benzofuran-3-carbaldehyde
5,7-dihydroxy-3-(4-hydroxy-2,5-dimethoxyphenyl)-8-(3-methylbut-2-en-1-yl)chromen-4-one
(3r,4as,6s,6as,8r,10ar,10bs)-8-bromo-3-ethenyl-6-hydroxy-3,4a,7,7,10a-pentamethyl-octahydronaphtho[2,1-b]pyran-10-one
C20H31BrO3 (398.14564359999997)