Exact Mass: 432.1431456
Exact Mass Matches: 432.1431456
Found 500 metabolites which its exact mass value is equals to given mass value 432.1431456,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
salvinorin A
D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D006213 - Hallucinogens A natural product found in Salvia divinorum.
Zizybeoside I
C19H28O11 (432.16315380000003)
Zizybeoside I is found in fruits. Zizybeoside I is isolated from Zizyphus jujuba (Chinese date Isolated from Zizyphus jujuba (Chinese date). Zizybeoside I is found in fruits.
5,6,7,8,3,4,5-Heptamethoxyflavone
Agecorynin C
A methoxyflavone that is flavone substituted by methoxy groups at positions 5, 6, 7, 8, 2, 4 and 5.
Medicocarpin
Isolated from roots of Medicago sativa (alfalfa) and Trifolium repens (white clover). Medicocarpin is found in many foods, some of which are alfalfa, herbs and spices, pulses, and tea. Medicocarpin is found in alfalfa. Medicocarpin is isolated from roots of Medicago sativa (alfalfa) and Trifolium repens (white clover). Medicarpin 3-O-glucoside. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=52766-70-8 (retrieved 2024-08-20) (CAS RN: 52766-70-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
3-Methoxynobiletin
3-Methoxynobiletin is a member of flavonoids and an ether. 3,3,4,5,6,7,8-Heptamethoxyflavone is a natural product found in Croton caudatus, Melicope triphylla, and other organisms with data available. See also: Tangerine peel (part of); Citrus aurantium fruit rind (part of). Isolated from Citrus subspecies peels. 3-Methoxynobiletin is found in sweet orange, sweet bay, and citrus. 3-Methoxynobiletin is found in citrus. 3-Methoxynobiletin is isolated from Citrus species peels. 3,5,6,7,8,3',4'-heptamethoxyflavone, a flavonoid in Citrus reticulata peels, exhibits anti-tumor-initiating effect and Anti-neuroinflammatory activity[1][2][3]. 3,5,6,7,8,3',4'-heptamethoxyflavone inhibits collagenase activity and increased type I procollagen content in HDFn cells[1]. 3,5,6,7,8,3',4'-heptamethoxyflavone induces brain-derived neurotrophic factor (BDNF) expression via cAMP/ERK/CREB signaling and reduces phosphodiesterase activity in C6 cells[4]. 3,5,6,7,8,3',4'-heptamethoxyflavone, a flavonoid in Citrus reticulata peels, exhibits anti-tumor-initiating effect and Anti-neuroinflammatory activity[1][2][3]. 3,5,6,7,8,3',4'-heptamethoxyflavone inhibits collagenase activity and increased type I procollagen content in HDFn cells[1]. 3,5,6,7,8,3',4'-heptamethoxyflavone induces brain-derived neurotrophic factor (BDNF) expression via cAMP/ERK/CREB signaling and reduces phosphodiesterase activity in C6 cells[4].
Licoagroside B
Licoagroside B is found in herbs and spices. Licoagroside B is isolated from hairy root cultures of Glycyrrhiza glabra (licorice). Isolated from hairy root cultures of Glycyrrhiza glabra (licorice). Licoagroside B is found in tea and herbs and spices.
Melledonal A
Melledonal A is found in mushrooms. Melledonal A is produced by Armillaria mellea (honey mushroom Production by Armillaria mellea (honey mushroom). Melledonal A is found in mushrooms.
Armillaricin
C24H29ClO5 (432.17034140000004)
Armillaricin is found in mushrooms. Armillaricin is a metabolite of Armillaria mellea (honey mushroom). Metabolite of Armillaria mellea (honey mushroom). Armillaricin is found in mushrooms.
Pinostrobin 5-glucoside
Pinostrobin 5-glucoside is found in fruits. Pinostrobin 5-glucoside is isolated from bark of morello cherry. Isolated from bark of morello cherry. Pinostrobin 5-glucoside is found in fruits.
(2S,4S,6S)-2-[2-(4-Hydroxy-3-meyhoxyphenyl)ethyl]tetrahydro-6-(4,5-dihydroxy-3-methoxyphenyl)-2H-pyran-4-yl 4-acetate
(2S,4S,6S)-2-[2-(4-Hydroxy-3-meyhoxyphenyl)ethyl]tetrahydro-6-(4,5-dihydroxy-3-methoxyphenyl)-2H-pyran-4-yl 4-acetate is found in herbs and spices. (2S,4S,6S)-2-[2-(4-Hydroxy-3-meyhoxyphenyl)ethyl]tetrahydro-6-(4,5-dihydroxy-3-methoxyphenyl)-2H-pyran-4-yl 4-acetate is a constituent of Zingiber officinale (ginger) Constituent of Zingiber officinale (ginger). (2S,4S,6S)-2-[2-(4-Hydroxy-3-meyhoxyphenyl)ethyl]tetrahydro-6-(4,5-dihydroxy-3-methoxyphenyl)-2H-pyran-4-yl 4-acetate is found in herbs and spices.
Trichocarposide
Trichocarposide is a constituent of Populus balsamifera (balsam poplar)
Apiosylglucosyl 4-hydroxybenzoate
Apiosylglucosyl 4-hydroxybenzoate is found in herbs and spices. Apiosylglucosyl 4-hydroxybenzoate occurs in sage.
4'-O-Methylglucoliquiritigenin
4-O-Methylglucoliquiritigenin is found in herbs and spices. 4-O-Methylglucoliquiritigenin is a constituent of the roots of Glycyrrhiza uralensis (Chinese licorice). Constituent of the roots of Glycyrrhiza uralensis (Chinese licorice). 4-Methylliquiritigenin 7-glucoside is found in herbs and spices.
Benzyl gentiobioside
C19H28O11 (432.16315380000003)
Benzyl gentiobioside is found in garden tomato. Benzyl gentiobioside is a constituent of tomato cell cultures (Lycopersicon esculentum Solanaceae). Constituent of tomato cell cultures (Lycopersicon esculentum Solanaceae). Benzyl gentiobioside is found in garden tomato.
15beta-hydroxycyproterone acetate
C24H29ClO5 (432.17034140000004)
15beta-hydroxycyproterone acetate is a metabolite of cyproterone. Cyproterone is a steroidal antiandrogen which was never marketed. An acylated derivative, cyproterone acetate, is widely used clinically used as an antiandrogen and progestin. While cyproterone is sometimes used as a synonym for cyproterone acetate, what is almost always being referred to is actually cyproterone acetate and not cyproterone. (Wikipedia)
Pseudolaric acid-B
1-(Perfluorohexyl)octane
C14H17F13 (432.11225979999995)
Asperulosidic acid
Captopril disulfide
Ilepatril
C22H28N2O5S (432.17188380000005)
O-Desmethyl Gefitinib
5-(1,1-Dihydroxythiazinan-2-yl)-N-[(4-fluorophenyl)methyl]-8-hydroxy-1,6-naphthyridine-7-carboxamide
C20H21FN4O4S (432.12674780000003)
Ulixertinib
C21H22Cl2N4O2 (432.11197319999997)
N,N-Dimethyl-5-({2-Methyl-6-[(5-Methylpyrazin-2-Yl)carbamoyl]-1-Benzofuran-4-Yl}oxy)pyrimidine-2-Carboxamide
(-)-medicarpin-3-O-glucoside
(-)-medicarpin-3-o-glucoside is a member of the class of compounds known as pterocarpans. Pterocarpans are benzo-pyrano-furano-benzene compounds, containing the 6H-[1]benzofuro[3,2-c]chromene skeleton. They are derivatives of isoflavonoids (-)-medicarpin-3-o-glucoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (-)-medicarpin-3-o-glucoside can be found in a number of food items such as pine nut, cupua√ßu, olive, and almond, which makes (-)-medicarpin-3-o-glucoside a potential biomarker for the consumption of these food products. (-)-medicarpin-3-o-glucoside is a member of the class of compounds known as pterocarpans. Pterocarpans are benzo-pyrano-furano-benzene compounds, containing the 6H-[1]benzofuro[3,2-c]chromene skeleton. They are derivatives of isoflavonoids (-)-medicarpin-3-o-glucoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (-)-medicarpin-3-o-glucoside can be found in a number of food items such as pine nut, cupuaçu, olive, and almond, which makes (-)-medicarpin-3-o-glucoside a potential biomarker for the consumption of these food products.
ACon1_001484
Asperulosidic acid is a glycoside and an iridoid monoterpenoid. Asperulosidic acid is a natural product found in Spermacoce alata, Knoxia roxburghii, and other organisms with data available. Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1]. ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2]. Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1]. ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2]. Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1]. ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2].
Asperulosidic
Asperulosidic acid is a glycoside and an iridoid monoterpenoid. Asperulosidic acid is a natural product found in Spermacoce alata, Knoxia roxburghii, and other organisms with data available. Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1]. ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2]. Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1]. ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2]. Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1]. ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2].
Asperulosidic acid
Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1]. ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2]. Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1]. ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2]. Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1]. ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2].
Osmanthuside H
C19H28O11 (432.16315380000003)
Trichodermamide A
C20H20N2O9 (432.11687500000005)
CONFIDENCE Penicillium corvianum
3,7-Dihydroxy-2,4-dimethoxyphenanthrene 3-O-glucoside
Artocommunol CA
Methyltetrapterol A
Calomelanol G
7-Hydroxy-3,4-methylenedioxyflavan 7-O-beta-D-glucopyranoside
3alpha,4alpha-Epoxy-9beta-hydroxy-8beta-(5-acetoxy-tiglinoyloxy)-2-oxo-3,4-dihydro-lasiolaenin
9-beta-Hydroxy-8beta-(5-acetoxy-tiglinoyloxy)-2-oxo-ludartin
3,5,6,7,3,4,5-Heptamethoxyflavone
2,3,4,5,2,6-Hexamethoxy-3,4-methylenedioxychalcone
Medicarpin glucoside
Pinostrobin 5-O-glucoside
(2R,3S,4S,5R,6R)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxane-3,4-diol
C19H28O11 (432.16315380000003)
(6aS)-5-chloro-9-[(2S,3R)-3-hydroxy-2-methylbutanoyl]-6a-methyl-3-[(1E,3S)-3-methylpent-1-en-1-yl]-6H-furo[2,3-h]isochromene-6,8(6aH)-dione
(+)-homonataloin|(-)-homonataloin|10-xi-D-Glucopyranosyl-2,8-dihydroxy-1-methoxy-6-methyl-anthron|10-xi-D-glucopyranosyl-2,8-dihydroxy-1-methoxy-6-methyl-anthrone|Homonataloin|Homonataloin B
beta-(5,7,4-trihydroxy-flavon-8-yl)-beta-phenylpropionic acid methyl ester
2-Methoxy-4-methylphenyl O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside
C19H28O11 (432.16315380000003)
3-hydroxy-4-[O-beta-D-apiofuranosyl-(1->6)-O-beta-D-glucopyranosyloxy]benzaldehyde|bretschneideroside B
Phenyl ethanol 4-O-??-D-xylopyranosyl-(1鈥樏傗垎6)-??-D-glucopyranoside
C19H28O11 (432.16315380000003)
(7R)-8-[1-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-yl]galangin
tyrosol 1-O-beta-D-xylopyranosyl-(1->6)-O-beta-D-glucopyranoside
C19H28O11 (432.16315380000003)
2-{4-[O-alpha-apiofuranosyl-(1->6)-beta-D-glucopyranosyloxy]phenyl}ethanol
C19H28O11 (432.16315380000003)
4-O-beta-D-glucopyranosyl-4-hydroxy-3-methoxychalcone
(-)-scorzotomentosin 4-O-beta-glucoside|4-[(3S)-3,4-dihydro-8-methoxy-1-oxo-1H-2-benzopyran-3-yl]phenyl beta-glucopyranoside
Me ester-5, 7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-beta-phenyl-4H-1-benzopyran-8-propanoic acid
naringenin-7-methylether-4-O-alpha-L-rhamnopyranoside
5-<(isovaleryloxy)methyl>-5-<4-(isovaleryloxy)but-3-ynyl>-2,2-bithiophene|5-isovaleryloxymethylene-2-(4-isovaleryloxybut-3-inyl)-dithiophene|5-isovaleryloxymethylene-2-(4-isovaleryloxybut-3-ynyl)dithiophene|Bis(3-methylbutanoyl)-4-[5-(Hydroxymethyl)-[2,2-bithiophen-5-yl]]-3-butyn-1-ol
(2S)-2-<2(6methoxy)-naphthyl>propionyl beta-D-glucopyranoside
scorzoveratrozit|scorzoveratrozit 4-O-beta-glucoside
2,3,4,6,7,8-Hexa-Me ether-2,3,4,5,6,7,8-Heptahydroxyflavone
2-(benzoyloxymethyl)phenyl (6-acetyl)-beta-beta-D-glucopyranoside|wenyujinoside
3-methoxyphenol 1-O-alpha-L-rhamnopyranosyl-(1?6)-O-beta-D-glucopyranoside
C19H28O11 (432.16315380000003)
8alpha-(5-hydroxysenecioyloxy)-3-oxo-1-desoxy-1,2-dehydrohirsutinolide-13-O-acetate
9-beta-hydroxy-atripliciolide-8-O-(5-acethoxytiglate)|9beta-hydroxyatripliciolide-8-O-(5-acetoxysarracinate)|conoprasiolide-5-O-acetate
2-C-methyl-D-erythritol 1-O-beta-D-(6-O-4-methoxybenzoyl)glucopyranoside|2-C-methyl-D-erythritol 1-O-[6-O-(4-methoxybenzoyl)-beta-D-glucopyranoside]|2-C-Methyl-D-erythritol 1-O-??-D-(6-O-4-methoxybenzoyl)glucopyranoside
C19H28O11 (432.16315380000003)
5,5a,12,12a-Tetrahydro-7,14-dimethoxybenzo[1,2:4,5;4,5:45]difuro[2,3-b:2,3-b]diindole-7b,14b-diol,
17,18-epoxy-8-O-acetyl-pumilin|17,18-epoxy-pumilin-8-O-acetate
2,3,4,5,2,6-hexamethoxy-4,5-methylenedioxychalcone
NCI60_026742
2-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one is a methoxyflavone that is flavone substituted by methoxy groups at positions 5, 6, 7, 8, 3, 4 and 5. It has a role as a plant metabolite. It is functionally related to a flavone. 5,6,7,8,3,4,5-Heptamethoxyflavone is a natural product found in Conoclinium coelestinum, Citrus medica, and other organisms with data available.
Conyzatin dimethyl ether
Hibiscetin heptamethyl ether is a member of flavonoids and an ether. Hibiscetin heptamethyl ether is a natural product found in Murraya exotica and Murraya paniculata with data available.
5-MethoxyPinocembroside
Captopril disulfide
An organic disulfide in which the disulfide bond links two units of captopril. It is a secondary metabolite of captopril.
(2R,3S,4S,5R,6R)-2-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[2-(4-hydroxyphenyl)ethoxy]oxane-3,4,5-triol
C19H28O11 (432.16315380000003)
(10R)-2,8-dihydroxy-1-methoxy-6-methyl-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one
3,5,7,8-tetramethoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one
Asperuloside acid
Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1]. ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2]. Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1]. ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2]. Asperulosidic Acid (ASPA), a bioactive iridoid glycoside, is extracted from the herbs of Hedyotis diffusa Willd. Asperulosidic Acid (ASPA) has anti-tumor, anti-oxidant, and anti-inflammatory activities[1]. ASPA is related to the inhibition of inflammatory cytokines (TNF-α, IL-6) and mediators via suppression of the NF-κB and mitogen-activated protein kinase (MAPK) signaling pathways[2].
C18H24O12_2-Methyl-4-oxo-4H-pyran-3-yl 6-O-(4-carboxy-3-hydroxy-3-methylbutanoyl)-beta-D-glucopyranoside
C18H24O12_Cyclopenta[c]pyran-4-carboxylic acid, 7-[(acetyloxy)methyl]-1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-5-hydroxy-, (1S,4aS,5S,7aS)
C19H28O11_beta-D-Glucopyranoside, 2-(4-hydroxyphenyl)ethyl 2-O-[(2S,3R,4R)-tetrahydro-3,4-dihydroxy-4-(hydroxymethyl)-2-furanyl]
C19H28O11 (432.16315380000003)
C23H20N4O5_(2S,4R,9aS)-1-Hydroxy-2,2-dimethyl-4-(4-oxo-3(4H)-quinazolinyl)-1,9a-dihydro-3H-spiro[furan-2,9-imidazo[1,2-a]indole]-3,5(2H,4H)-dione
C19H28O11_Benzyl 6-O-beta-D-glucopyranosyl-beta-D-glucopyranoside
C19H28O11 (432.16315380000003)
C22H24O9_(3aS,4S,5R,7aS,8aS,8cS)-5-Hydroxy-6,8a-dimethyl-3-methylene-2,7-dioxo-2,3,3a,4,5,7,7a,8a,8b,8c-decahydrooxireno[2,3]azuleno[4,5-b]furan-4-yl (2E)-2-(acetoxymethyl)-2-butenoate
(1S,4aS,5S,7aS)-7-(acetyloxymethyl)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
3-hydroxy-3-methyl-5-oxo-5-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(2-methyl-4-oxopyran-3-yl)oxyoxan-2-yl]methoxy]pentanoic acid
Chaetoviridin A
An azaphilone that is 6H-furo[2,3-h]isochromene-6,8(6aH)-dione substituted by a chloro group at position 5, a 3-hydroxy-2-methylbutanoyl group at position 9, a methyl group at position 6a and a 3-methylpent-1-en-1yl group at position 3. Isolated from Chaetomium globosum, it exhibits natifungal activity against plant pathogenic fungi. CONFIDENCE isolated standard
Ilepatril
C22H28N2O5S (432.17188380000005)
CONFIDENCE standard compound; INTERNAL_ID 1338; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4207; ORIGINAL_PRECURSOR_SCAN_NO 4205 C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent CONFIDENCE standard compound; INTERNAL_ID 1338; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4238; ORIGINAL_PRECURSOR_SCAN_NO 4236 CONFIDENCE standard compound; INTERNAL_ID 1338; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4229; ORIGINAL_PRECURSOR_SCAN_NO 4226 CONFIDENCE standard compound; INTERNAL_ID 1338; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4224; ORIGINAL_PRECURSOR_SCAN_NO 4221 CONFIDENCE standard compound; INTERNAL_ID 1338; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4237; ORIGINAL_PRECURSOR_SCAN_NO 4235 CONFIDENCE standard compound; INTERNAL_ID 1338; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8771; ORIGINAL_PRECURSOR_SCAN_NO 8768 CONFIDENCE standard compound; INTERNAL_ID 1338; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8784; ORIGINAL_PRECURSOR_SCAN_NO 8782 CONFIDENCE standard compound; INTERNAL_ID 1338; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8787; ORIGINAL_PRECURSOR_SCAN_NO 8785 CONFIDENCE standard compound; INTERNAL_ID 1338; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8812; ORIGINAL_PRECURSOR_SCAN_NO 8809 CONFIDENCE standard compound; INTERNAL_ID 1338; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8809; ORIGINAL_PRECURSOR_SCAN_NO 8804 CONFIDENCE standard compound; INTERNAL_ID 1338; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8820; ORIGINAL_PRECURSOR_SCAN_NO 8818
(2R,3S,4S,5R,6R)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxane-3,4-diol_major
C19H28O11 (432.16315380000003)
(1S,4aS,5S,7aS)-7-(acetyloxymethyl)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid_major
Ala Cys Cys His
Ala Cys His Cys
Ala Asp Met Pro
Ala Asp Asn Asn
Ala Asp Pro Met
Ala His Cys Cys
Ala Met Asp Pro
Ala Met Pro Asp
Ala Asn Asp Asn
Ala Asn Asn Asp
Ala Pro Asp Met
Ala Pro Met Asp
Cys Ala Cys His
Cys Ala His Cys
Cys Cys Ala His
Cys Cys His Ala
Cys Asp Pro Val
Cys Asp Val Pro
Cys His Ala Cys
Cys His Cys Ala
Cys His Ser Ser
Cys Pro Asp Val
Cys Pro Val Asp
Cys Ser His Ser
Cys Ser Ser His
Cys Val Asp Pro
Cys Val Pro Asp
Asp Ala Met Pro
Asp Ala Asn Asn
Asp Ala Pro Met
Asp Cys Pro Val
Asp Cys Val Pro
Asp Asp Pro Ser
C16H24N4O10 (432.14923639999995)
Asp Asp Ser Pro
C16H24N4O10 (432.14923639999995)
Asp Gly Asn Gln
Asp Gly Gln Asn
Asp Met Ala Pro
Asp Met Pro Ala
Asp Asn Ala Asn
Asp Asn Gly Gln
Asp Asn Asn Ala
Asp Asn Gln Gly
Asp Pro Ala Met
Asp Pro Cys Val
Asp Pro Asp Ser
C16H24N4O10 (432.14923639999995)
Asp Pro Met Ala
Asp Pro Ser Asp
C16H24N4O10 (432.14923639999995)
Asp Pro Val Cys
Asp Gln Gly Asn
Asp Gln Asn Gly
Asp Ser Asp Pro
C16H24N4O10 (432.14923639999995)
Asp Ser Pro Asp
C16H24N4O10 (432.14923639999995)
Asp Val Cys Pro
Asp Val Pro Cys
Glu Gly Met Pro
Glu Gly Asn Asn
Glu Gly Pro Met
Glu Met Gly Pro
Glu Met Pro Gly
Glu Asn Gly Asn
Glu Asn Asn Gly
Glu Pro Gly Met
Glu Pro Met Gly
Gly Asp Asn Gln
Gly Asp Gln Asn
Gly Glu Met Pro
Gly Glu Asn Asn
Gly Glu Pro Met
Gly Gly His Tyr
Gly Gly Asn Trp
Gly Gly Trp Asn
Gly Gly Tyr His
Gly His Gly Tyr
Gly His Tyr Gly
Gly Met Glu Pro
Gly Met Pro Glu
Gly Asn Asp Gln
Gly Asn Glu Asn
Gly Asn Gly Trp
Gly Asn Asn Glu
Gly Asn Gln Asp
Gly Asn Trp Gly
Gly Pro Glu Met
Gly Pro Met Glu
Gly Gln Asp Asn
Gly Gln Asn Asp
Gly Trp Gly Asn
Gly Trp Asn Gly
Gly Tyr Gly His
Gly Tyr His Gly
His Ala Cys Cys
His Cys Ala Cys
His Cys Cys Ala
His Cys Ser Ser
His Gly Gly Tyr
His Gly Tyr Gly
His Ser Cys Ser
His Ser Ser Cys
His Tyr Gly Gly
Met Ala Asp Pro
Met Ala Pro Asp
Met Asp Ala Pro
Met Asp Pro Ala
Met Glu Gly Pro
Met Glu Pro Gly
Met Gly Glu Pro
Met Gly Pro Glu
Met Pro Ala Asp
Met Pro Asp Ala
Met Pro Glu Gly
Met Pro Gly Glu
Asn Ala Asp Asn
Asn Ala Asn Asp
Asn Asp Ala Asn
Asn Asp Gly Gln
Asn Asp Asn Ala
Asn Asp Gln Gly
Asn Glu Gly Asn
Asn Glu Asn Gly
Asn Gly Asp Gln
Asn Gly Glu Asn
Asn Gly Gly Trp
Asn Gly Asn Glu
Asn Gly Gln Asp
Asn Gly Trp Gly
Asn Asn Ala Asp
Asn Asn Asp Ala
Asn Asn Glu Gly
Asn Asn Gly Glu
Asn Gln Asp Gly
Asn Gln Gly Asp
Asn Trp Gly Gly
Pro Ala Asp Met
Pro Ala Met Asp
Pro Cys Asp Val
Pro Cys Val Asp
Pro Asp Ala Met
Pro Asp Cys Val
Pro Asp Asp Ser
C16H24N4O10 (432.14923639999995)
Pro Asp Met Ala
Pro Asp Ser Asp
C16H24N4O10 (432.14923639999995)
Pro Asp Val Cys
Pro Glu Gly Met
Pro Glu Met Gly
Pro Gly Glu Met
Pro Gly Met Glu
Pro Met Ala Asp
Pro Met Asp Ala
Pro Met Glu Gly
Pro Met Gly Glu
Pro Ser Asp Asp
C16H24N4O10 (432.14923639999995)
Pro Val Cys Asp
Pro Val Asp Cys
Gln Asp Gly Asn
Gln Asp Asn Gly
Gln Gly Asp Asn
Gln Gly Asn Asp
Gln Asn Asp Gly
Gln Asn Gly Asp
Ser Cys His Ser
Ser Cys Ser His
Ser Asp Asp Pro
C16H24N4O10 (432.14923639999995)
Ser Asp Pro Asp
C16H24N4O10 (432.14923639999995)
Ser His Cys Ser
Ser His Ser Cys
Ser Pro Asp Asp
C16H24N4O10 (432.14923639999995)
Ser Ser Cys His
Ser Ser His Cys
Val Cys Asp Pro
Val Cys Pro Asp
Val Asp Cys Pro
Val Asp Pro Cys
Val Pro Cys Asp
Val Pro Asp Cys
Trp Gly Gly Asn
Trp Gly Asn Gly
Trp Asn Gly Gly
Tyr Gly Gly His
Tyr Gly His Gly
Tyr His Gly Gly
TyrMe-Asp-OH
C20H20N2O9 (432.11687500000005)
Trichocarposide
Apiosylglucosyl 4-hydroxybenzoate
Licoagroside B
A monosaccharide derivative resulting from the formal condensation of the hydroxy group of 2-methyl-4-oxo-4H-pyran-3-yl beta-D-glucopyranoside with the carboxy group of 3-hydroxy-3-methylglutaric acid.
Armillaricin
C24H29ClO5 (432.17034140000004)
4'-O-Methylglucoliquiritigenin
Benzyl gentiobioside
C19H28O11 (432.16315380000003)
Darendoside A
C19H28O11 (432.16315380000003)
ethyl 1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-piperazin-1-yl-1,8-naphthyridine-3-carboxylate
C21H19F3N4O3 (432.14091800000006)
2-(1-Trityl-1H-tetrazol-5-yl)phenylboronic acid
C26H21BN4O2 (432.17574759999997)
Benzoic acid, 4-(5-cyano-1,6-dihydro-2-hydroxy-1,4-dimethyl-6-oxo-3-pyridinyl)azo-, 2-phenoxyethyl ester
1-ethyl-2-[3-(1-ethylquinolin-1-ium-2-yl)prop-2-enylidene]quinoline,bromide
3-((3-((tert-Butyldimethylsilyloxy)methyl)-pyrrolidin-1-yl)methyl)-5-iodopyridine
C17H29IN2OSi (432.10938139999996)
2-((Benzoyloxy)methyl)-2-methyldibenzoate-1,3-propanediol
Fmoc-(R)-3-Amino-3-(4-Nitro-Phenyl)-Propionic Acid
GSK429286A
C21H16F4N4O2 (432.12093239999996)
Fmoc-(R)-3-Amino-3-(2-Nitro-Phenyl)-Propionic Acid
1-(4-methoxyphenyl)-7,7-dimethyl-3-[(3-nitrophenyl)methyl]-6,8-dihydroquinoline-2,5-dione
bis(4-(4-aminophenoxy)phenyl)sulfone
C24H20N2O4S (432.11437200000006)
N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-3-nitro-D-phenylalanine
1-(2,4-difluorophenyl)-7-(4-ethylpiperazin-1-yl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
C21H19F3N4O3 (432.14091800000006)
3-[4-(3-methylsulfinyl-11-oxo-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]propan-1-ol
C22H28N2O3S2 (432.15412580000003)
5-CHLORO-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1-TOSYL-1H-PYRROLO[2,3-B]PYRIDINE
C20H22BClN2O4S (432.10817920000005)
1-BOC-4-(2-(4-FLUORO-3-(TRIFLUOROMETHYL)PHENYL)-2-OXOETHYLCARBAMOYL)PIPERIDINE
Torin 2
Torin 2 is an mTOR inhibitor with EC50 of 0.25 nM for inhibiting cellular mTOR activity, and exhibits 800-fold selectivity over PI3K (EC50: 200 nM). Torin 2 also inhibits DNA-PK with an IC50 of 0.5 nM in the cell free assay. Torin 2 can suppress both mTORC1 and mTORC2. Torin 2 is an mTOR inhibitor with EC50 of 0.25 nM for inhibiting cellular mTOR activity, and exhibits 800-fold selectivity over PI3K (EC50: 200 nM). Torin 2 also inhibits DNA-PK with an IC50 of 0.5 nM in the cell free assay. Torin 2 can suppress both mTORC1 and mTORC2.
2-(9H-FLUOREN-9-YLMETHOXYCARBONYLAMINO)-3-(4-NITRO-PHENYL)-PROPIONIC ACID
[2-[1-(TRIPHENYLMETHYL)-1H-TETRAZOL-5-YL]PHENYL]BORONIC ACID
C26H21BN4O2 (432.17574759999997)
Ulixertinib
C21H22Cl2N4O2 (432.11197319999997)
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor Ulixertinib (BVD-523; VRT752271) is a potent, orally active, highly selective, ATP-competitive and reversible covalent inhibitor of ERK1/2 kinases, with an IC50 of <0.3 nM against ERK2. Ulixertinib (BVD-523; VRT752271) inhibits the phosphorylated ERK2 (pERK) and downstream kinase RSK (pRSK) in an A375 melanoma cell line[1][2].
Fmoc-(R)-3-Amino-3-(3-nitro-phenyl)-propionic acid
Timolol maleate
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents (S)-Timolol Maleate (L-714,465 Maleate) is a non-cardioselective hydrophilic β-adrenoceptor blocker. (S)-Timolol Maleate is widely used as standard medication for intraocular pressure (glaucoma) by preventing the production of aqueous humor. (S)-Timolol Maleate can be used for hypertension, angina pectoris and myocardial infarction[1][2][3].
(+/-)-4-[4-(dimethylamino)-1-(4-fluorophenyl)-1-hydroxybutyl]-3-(hydroxymethyl)-benzonitrile, oxalate
C22H25FN2O6 (432.16965619999996)
D-xylo-Pentodialdo-5,2-furanose, 1-C-[4-chloro-3-[(4-ethoxyphenyl)Methyl]phenyl]-4,5-O-(1-Methylethylidene)-,(5S)-
Ethyl 1-thio-beta-D-galactopyranoside 2,3-dibenzoate
3,3-[Sulfonylbis(4,1-phenyleneoxy)]dianiline
C24H20N2O4S (432.11437200000006)
Parsaclisib
L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01E - Protein kinase inhibitors > L01EM - Phosphatidylinositol-3-kinase (pi3k) inhibitors C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C2152 - Phosphatidylinositide 3-Kinase Inhibitor C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor
N,N-Dimethyl-5-({2-Methyl-6-[(5-Methylpyrazin-2-Yl)carbamoyl]-1-Benzofuran-4-Yl}oxy)pyrimidine-2-Carboxamide
Methyl N-[(4-methylphenyl)sulfonyl]glycyl-3-[amino(imino)methyl]-D-phenylalaninate
2-(6-Chloro-3-{[2,2-difluoro-2-(2-pyridinyl)ethyl]amino}-2-oxo-1(2H)-pyrazinyl)-N-[(2-fluoro-6-pyridinyl)methyl]acetamide
2-[({2-[(1Z)-3-(Dimethylamino)prop-1-enyl]-4-fluorophenyl}sulfonyl)amino]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
5-Epichaetoviridin A
An azaphilone that is the 5-epimer of chaetoviridin A. It has been isolated from Chaetomium globosum.
N-(1H-benzimidazol-2-ylmethyl)-2-(4-morpholinyl)-9-(3-thiophenyl)-6-purinamine
N-(furan-2-ylmethylcarbamoyl)-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]acetamide
Ketone, 2-ethoxy-2,4-diphenyl-2H-1-benzopyran-3-yl phenyl
N-(Tert-Butyl)-4-[5-(Pyridin-2-Ylamino)quinolin-3-Yl]benzenesulfonamide
Medicarpin glucoside
10-44-6
C19H28O11 (432.16315380000003)
[(2R,4aS,7aS,7bR)-3-formyl-6,6,7b-trimethyl-2,4,4a,5,7,7a-hexahydro-1H-cyclobuta[e]inden-2-yl] 3-chloro-6-hydroxy-4-methoxy-2-methylbenzoate
C24H29ClO5 (432.17034140000004)
4-Epichaetoviridin A
An azaphilone that is the 4-epimer of chaetoviridin A. It has been isolated from Chaetomium globosum.
4-(4-Methoxyphenyl)-3-(4-methylphenyl)-5-[(4-nitrophenyl)methylthio]-1,2,4-triazole
C23H20N4O3S (432.12560500000006)
4-methyl-N-[2-(phenylmethyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]benzenesulfonamide
N-(1H-benzimidazol-2-yl)-3-[phenyl(prop-2-enyl)sulfamoyl]benzamide
C23H20N4O3S (432.12560500000006)
N-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(3-hydroxypropyl)benzenesulfonamide
5-Morpholin-4-yl-9-m-tolyl-1,2,3,4-tetrahydro-9H-7-thia-6,9,11-triaza-benzo[c]fluoren-8-one
2-Phenylacetic acid [2-[4-[(4-ethoxyanilino)-oxomethyl]anilino]-2-oxoethyl] ester
N-[(E)-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methylideneamino]benzenesulfonamide
C23H20N4O3S (432.12560500000006)
4-[[1-(2-Furanylmethyl)-2,4,6-trioxo-3-propan-2-yl-1,3-diazinan-5-ylidene]methylamino]benzenesulfonamide
C19H20N4O6S (432.11035000000004)
N-cyclopentyl-2-[2-oxolanylmethyl-(1-oxo-2-thiophen-2-ylethyl)amino]-2-thiophen-2-ylacetamide
C22H28N2O3S2 (432.15412580000003)
ethyl (2Z)-2-[(5Z)-5-[(2-methoxyphenyl)methylidene]-3-(2-morpholin-4-yl-2-oxoethyl)-4-oxo-1,3-thiazolidin-2-ylidene]acetate
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-N-[(E)-[4-[(3-methylphenyl)methoxy]phenyl]methylideneamino]triazole-4-carboxamide
C21H20N8O3 (432.16582900000003)
2-[5-(4-Fluorophenoxy)-4-(trifluoromethyl)biphenyl-3-yl]pentanoic acid
2-[(2S,5S,6S)-5-(ethylsulfonylamino)-6-(hydroxymethyl)-2-oxanyl]-N-(4-phenylphenyl)acetamide
C22H28N2O5S (432.17188380000005)
(1S,2aR,8bR)-N-(4-fluorophenyl)-1-(hydroxymethyl)-2-[oxo(3-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide
C24H21FN4O3 (432.15976079999996)
(1S,2aS,8bS)-N-(2-fluorophenyl)-1-(hydroxymethyl)-4-[oxo(2-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-2-carboxamide
C24H21FN4O3 (432.15976079999996)
2-[(3S,6aR,8R,10aR)-1-(2-chlorophenyl)sulfonyl-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-methylacetamide
C18H25ClN2O6S (432.11217800000003)
(6S,7R,8S)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
C24H21FN4O3 (432.15976079999996)
(6R,7R,8S)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
C24H21FN4O3 (432.15976079999996)
(6R,7R,8R)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
C24H21FN4O3 (432.15976079999996)
2-[(2S,5R,6S)-5-(ethylsulfonylamino)-6-(hydroxymethyl)-2-oxanyl]-N-(4-phenylphenyl)acetamide
C22H28N2O5S (432.17188380000005)
2-[(2R,5S,6R)-5-(ethylsulfonylamino)-6-(hydroxymethyl)-2-oxanyl]-N-(4-phenylphenyl)acetamide
C22H28N2O5S (432.17188380000005)
2-[(2R,5R,6S)-5-(ethylsulfonylamino)-6-(hydroxymethyl)-2-oxanyl]-N-(4-phenylphenyl)acetamide
C22H28N2O5S (432.17188380000005)
2-[(2R,5S,6S)-5-(ethylsulfonylamino)-6-(hydroxymethyl)-2-oxanyl]-N-(4-phenylphenyl)acetamide
C22H28N2O5S (432.17188380000005)
(1R,2aS,8bS)-N-(4-fluorophenyl)-1-(hydroxymethyl)-2-[oxo(3-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide
C24H21FN4O3 (432.15976079999996)
(1S,2aS,8bS)-N-(4-fluorophenyl)-1-(hydroxymethyl)-2-[oxo(3-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide
C24H21FN4O3 (432.15976079999996)
(1R,2aR,8bR)-N-(4-fluorophenyl)-1-(hydroxymethyl)-2-[oxo(3-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide
C24H21FN4O3 (432.15976079999996)
(1S,2aR,8bR)-N-(2-fluorophenyl)-1-(hydroxymethyl)-4-[oxo(2-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-2-carboxamide
C24H21FN4O3 (432.15976079999996)
(1R,2aS,8bS)-N-(2-fluorophenyl)-1-(hydroxymethyl)-4-[oxo(2-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-2-carboxamide
C24H21FN4O3 (432.15976079999996)
(1R,2aR,8bR)-N-(2-fluorophenyl)-1-(hydroxymethyl)-4-[oxo(2-pyridinyl)methyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-2-carboxamide
C24H21FN4O3 (432.15976079999996)
(6S,7S,8S)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
C24H21FN4O3 (432.15976079999996)
(6R,7S,8S)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
C24H21FN4O3 (432.15976079999996)
(6R,7S,8R)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
C24H21FN4O3 (432.15976079999996)
(6S,7R,8R)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
C24H21FN4O3 (432.15976079999996)
(6S,7S,8R)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(2-pyrazinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
C24H21FN4O3 (432.15976079999996)
3,4,5-Trihydroxy-6-[5-methoxy-2-(3-phenylpropanoyl)phenoxy]oxane-2-carboxylic acid
2-Chloro-4-[[6-[3-(3-hydroxypropylamino)propoxy]-7-methoxyquinazolin-4-yl]amino]phenol
[2-ethoxy-4-[(Z)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenyl] thiophene-2-carboxylate
C24H20N2O4S (432.11437200000006)
N-(3-chloro-4-fluorophenyl)-7-methoxy-6-[3-[methyl(propyl)amino]propoxy]quinazolin-4-amine
[2-Hydroxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropyl] hexanoate
C15H29O12P (432.13965640000004)
2-(3,4,5-Trimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one
A methoxyflavone that is flavone substituted by methoxy groups at positions 5, 6, 7, 8, 3, 4 and 5.
FABP-IN-2
FABP-IN-2 is a novel FABP3 ligand. FABP-IN-2 inhibits FABP3/FABP4 with an IC50 of 1.16 μM and 4.27 μM respectively[1].
ML-298
ML298 is a potent and selective inhibitor of Phospholipase D2 (PLD2) with an IC50 of 355 nM. ML298 decreases invasive migration in U87-MG glioblastoma cells[1].
Plazinemdor
C21H19ClF2N4O2 (432.11645280000005)
Plazinemdor is a N-methyl-D-aspartate(NMDA) receptor positive allosteric modulator. Plazinemdor can be uses in the research of psychiatric, neurological, and neurodevelopmental disorders, as well as diseases of the nervous system[1]..
(3r)-3-hydroxy-3-methyl-5-oxo-5-{[(2r,3s,4s,5s,6s)-3,4,5-trihydroxy-6-[(2-methyl-4-oxopyran-3-yl)oxy]oxan-2-yl]methoxy}pentanoic acid
(3s)-3-hydroxy-3-methyl-5-oxo-5-{[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-[(2-methyl-4-oxopyran-3-yl)oxy]oxan-2-yl]methoxy}pentanoic acid
2-[(2s,5z)-3,6-dihydroxy-5-(2-methylpropylidene)-2h-pyrazin-2-yl]propan-2-yl 2-[(4-nitrophenyl)formamido]acetate
(6r,6ar,9s,9as)-9-acetyl-5-chloro-3-[(1e,3e,5s)-3,5-dimethylhepta-1,3-dien-1-yl]-6-methoxy-6a-methyl-6h,9h,9ah-furo[2,3-h]isochromen-8-one
C24H29ClO5 (432.17034140000004)
(2r,3s,4s,5r,6r)-2-({[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxane-3,4,5-triol
C19H28O11 (432.16315380000003)
(1s,2e,8s,10s)-6-[(acetyloxy)methyl]-1,10-dimethyl-5,13-dioxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6,11-trien-8-yl (2z)-4-hydroxy-3-methylbut-2-enoate
3,5,6,7-tetramethoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one
n-[(2r,3r,4s,5r)-1,4,5,6-tetrakis(acetyloxy)-2-[(1-hydroxyethylidene)amino]hexan-3-yl]ethanimidic acid
3-(4-methoxyphenyl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzopyran-4-one
11'-hydroxy-8'a,9'-dimethyl-3,3',7'-trioxo-1',5',5'a,8',9',10',11',11'b-octahydro-4,6-dioxaspiro[bicyclo[3.1.0]hexane-2,6'-phenaleno[1,9a-c]furan]-10'-yl acetate
(2r,4'as,5'r,5''s,6's,7'r,8'as)-5''-(furan-3-yl)-7'-hydroxy-6'-methyl-2',2'',8'-trioxo-tetrahydro-3'h-dispiro[oxirane-2,1'-naphthalene-5',3''-oxolan]-8'a-ylmethyl acetate
(1s,4as,5s,7as)-7-[(acetyloxy)methyl]-5-hydroxy-1-{[(2s,3r,4s,5s,6s)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-1h,4ah,5h,7ah-cyclopenta[c]pyran-4-carboxylic acid
9'-hydroxy-8'a,9'-dimethyl-3,3',7'-trioxo-5',5'a,8',10',11',11'b-hexahydro-1'h-4,6-dioxaspiro[bicyclo[3.1.0]hexane-2,6'-phenaleno[3,3a-c]furan]-10'-yl acetate
(2e)-6-[(acetyloxy)methyl]-1,10-dimethyl-5,13-dioxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6,11-trien-8-yl 4-hydroxy-3-methylbut-2-enoate
1-(4,6-dimethoxy-2h-1,3-benzodioxol-5-yl)-3-(2,3,4,5-tetramethoxyphenyl)prop-2-en-1-one
(1s,10s,18s)-4,15-dihydroxy-18-(hydroxymethyl)-3,5,14,16-tetramethoxy-8-oxatetracyclo[8.7.1.0²,⁷.0¹²,¹⁷]octadeca-2(7),3,5,12(17),13,15-hexaen-11-one
(1s,2e,8s,10s)-6-[(acetyloxy)methyl]-1,10-dimethyl-5,13-dioxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6,11-trien-8-yl (2e)-4-hydroxy-3-methylbut-2-enoate
(4as,5r,8r,8as)-n-(7,8-dimethoxy-2-oxochromen-3-yl)-4a,5,8-trihydroxy-4,5,8,8a-tetrahydro-1,2-benzoxazine-3-carboxamide
C20H20N2O9 (432.11687500000005)