Exact Mass: 424.1933
Exact Mass Matches: 424.1933
Found 500 metabolites which its exact mass value is equals to given mass value 424.1933,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Benazepril
Benazepril, brand name Lotensin, is a medication used to treat high blood pressure (hypertension), congestive heart failure, and chronic renal failure. Upon cleavage of its ester group by the liver, benazepril is converted into its active form benazeprilat, a non-sulfhydryl angiotensin-converting enzyme (ACE) inhibitor. C - Cardiovascular system > C09 - Agents acting on the renin-angiotensin system > C09A - Ace inhibitors, plain > C09AA - Ace inhibitors, plain D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D000806 - Angiotensin-Converting Enzyme Inhibitors C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent C471 - Enzyme Inhibitor > C783 - Protease Inhibitor > C247 - ACE Inhibitor D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents
2,2-Dimethyl-3-(4-methoxyphenyl)-4-ethyl-7-hydroxy-2H-1-benzopyran-8-methanol diacetate
Sophoraflavanone G
Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways. Sophoraflavanone G. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=97938-30-2 (retrieved 2024-10-11) (CAS RN: 97938-30-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
beta-Mangostin
Beta-Mangostin is a member of xanthones. beta-Mangostin is a natural product found in Garcinia oliveri, Garcinia cowa, and other organisms with data available. From Garcinia mangostana (mangosteen). beta-Mangostin is found in fruits and purple mangosteen. beta-Mangostin is found in fruits. beta-Mangostin is from Garcinia mangostana (mangosteen). beta-Mangostin (β-Mangostin) is a xanthone compound present in Cratoxylum arborescens, with antibacterial and antimalarial activities. beta-Mangostin exhibits antimycobacterial activity against Mycobacterium tuberculosis with an MIC of 6.25 μg/mL. beta-Mangostin possesses in vitro antimalarial activity against Plasmodium falciparum, with an IC50 of 3.00 μg/mL. beta-Mangostin has potent anticancer activity against various cancers (such as hepatocellular carcinoma, leukaemic)[1][2][3][4]. beta-Mangostin (β-Mangostin) is a xanthone compound present in Cratoxylum arborescens, with antibacterial and antimalarial activities. beta-Mangostin exhibits antimycobacterial activity against Mycobacterium tuberculosis with an MIC of 6.25 μg/mL. beta-Mangostin possesses in vitro antimalarial activity against Plasmodium falciparum, with an IC50 of 3.00 μg/mL. beta-Mangostin has potent anticancer activity against various cancers (such as hepatocellular carcinoma, leukaemic)[1][2][3][4].
(S)-3',4',5,7-Tetrahydroxy-5',8-diprenylflavanone
(S)-3,4,5,7-Tetrahydroxy-5,8-diprenylflavanone is found in herbs and spices. (S)-3,4,5,7-Tetrahydroxy-5,8-diprenylflavanone is isolated from Glycyrrhiza uralensis (Chinese licorice). Isolated from Glycyrrhiza uralensis (Chinese licorice). Gancaonin E is found in herbs and spices.
Dulxanthone C
Dulxanthone C is found in fruits. Dulxanthone C is a constituent of the stem bark of Garcinia dulcis (mundu)
Glisoflavanone
(±)-Glisoflavanone is found in herbs and spices. (±)-Glisoflavanone is a constituent of Glycyrrhiza uralensis (Chinese licorice). Constituent of Glycyrrhiza uralensis (Chinese licorice). (±)-Glisoflavanone is found in herbs and spices.
1,7-Dihydroxy-3,6-dimethoxy-2,8-diprenylxanthone
1,7-Dihydroxy-3,6-dimethoxy-2,8-diprenylxanthone is found in fruits. 1,7-Dihydroxy-3,6-dimethoxy-2,8-diprenylxanthone is a constituent of Garcinia mangostana (mangosteen). Constituent of Garcinia mangostana (mangosteen). 1,7-Dihydroxy-3,6-dimethoxy-2,8-diprenylxanthone is found in fruits.
(±)-2',4',5,7-Tetrahydroxy-3',8-diprenylisoflavanone
(±)-2,4,5,7-Tetrahydroxy-3,8-diprenylisoflavanone is found in herbs and spices. (±)-2,4,5,7-Tetrahydroxy-3,8-diprenylisoflavanone is isolated from Phaseolus lunatus (butter bean) seedlings under stress and from Glycyrrhiza glabra (licorice Isolated from Phaseolus lunatus (butter bean) seedlings under stress and from Glycyrrhiza glabra (licorice). (±)-2,4,5,7-Tetrahydroxy-3,8-diprenylisoflavanone is found in tea, herbs and spices, and pulses.
3-Methyl-2-butenyl-(-)-piperitol
3-Methyl-2-butenyl-(-)-piperitol is found in herbs and spices. 3-Methyl-2-butenyl-(-)-piperitol is a constituent of Zanthoxylum piperitum (Japanese pepper tree). Constituent of Zanthoxylum piperitum (Japanese pepper tree). 3-Methyl-2-butenyl-(-)-piperitol is found in herbs and spices.
Delapril diacid
Sophoraflavanone G
Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2]. Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2].
Lys-Asp-Tyr
Cowaxanthone B
Cowaxanthone B is a natural product found in Garcinia cowa and Cratoxylum arborescens with data available.
Kuwanon E
Kuwanon E is a member of flavanones. 4H-1-Benzopyran-4-one, 2-(5-((2E)-3,7-dimethyl-2,6-octadienyl)-2,4-dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-, (2S)- is a natural product found in Morus lhou, Morus mongolica, and other organisms with data available.
Sophoraflavanone_G
Sophoraflavanone G is a tetrahydroxyflavanone having a structure of naringenin bearing an additional hydroxyl substituent at position 2 as well as a (2R)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl (lavandulyl) substituent at position 8. It has a role as an antioxidant, an antimalarial, an antimicrobial agent and a plant metabolite. It is a tetrahydroxyflavanone, a member of 4-hydroxyflavanones and a (2S)-flavan-4-one. It is functionally related to a (S)-naringenin. Sophoraflavanone G is a natural product found in Sophora stenophylla, Sophora moorcroftiana, and other organisms with data available. A tetrahydroxyflavanone having a structure of naringenin bearing an additional hydroxyl substituent at position 2 as well as a (2R)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl (lavandulyl) substituent at position 8. Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2]. Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2].
FLLL-31
Tetramethylcurcumin (FLLL31), derived from curcumin, specifically suppresses the phosphorylation of STAT3 by binding selectively to Janus kinase 2 and the STAT3 Src homology-2 domain. Tetramethylcurcumin exhibits anti-inflammatory and anti-cancer effects[1][2].
Sophoraflavanone L
A trihydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5, 2 and 4, a prenyl group at position 8 and a prenyloxy group at position 7. Isolated from the roots of Sophora flavescens, it exhibits cytotoxicity towards KB epidermoid carcinoma cell line. Sophoraflavanone L is a trihydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5, 2' and 4', a prenyl group at position 8 and a prenyloxy group at position 7. Isolated from the roots of Sophora flavescens, it exhibits cytotoxicity towards KB epidermoid carcinoma cell line. It has a role as a metabolite and an antineoplastic agent. It is a trihydroxyflavanone and a member of 4'-hydroxyflavanones. 2-(2,4-Dihydroxyphenyl)-2,3-dihydro-5-hydroxy-8-(3-methyl-2-buten-1-yl)-7-[(3-methyl-2-buten-1-yl)oxy]-4H-1-benzopyran-4-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=910459-01-7 (retrieved 2024-11-13) (CAS RN: 910459-01-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
Orientanol E
arugosin A (lactol form)
A dibenzooxepine that is dibenzo[b,e]oxepin-11(6H)-one which is substituted by hydroxy groups at positions 1, 6, and 10, a 3,3-dimethylallyl group at position 2, a 3,3-dimethylallyloxy group at position 7, and a methyl group at position 8.
arugosin B
A dibenzooxepine that is dibenzo[b,e]oxepin-11(6H)-one substituted by hydroxy groups at positions 1, 6 and 10, a methyl group at position 8, a prenyl group at position 4 and a prenyloxy group at position 7. Isolated from Aspergillus, it exhibits antibacterial activity.
24-Dihydroxy-5-(1,1-dimethylallyl)-6-C-prenylpinocembrin
Tetrapterol G
Lonchocarpol D1
Variecoxanthone C
A member of the class of xanthones that is 9H-xanthen-9-one substituted by a (3,3-dimethyoxiran-2-yl)methyl group at position 5, a hydroxy group at position 8, a hydroxymethyl group at position 1, a methyl group at position 3 and a prenyloxy group at position 2. It has been isolated from Aspergillus.
Lespedezol D5
Bonanniol A
Lonchocarpol C1
Arugosin C
An organic heterotetracyclic compound that is 1,12a-dihydrochromeno[4,5-bc][1]benzoxepin-7(2H)-one substituted by a hydroxy group at position 8, a 2-hydroxypropan-2-yl group at position 1, a methyl group at position 4 and a prenyl group at position 9. Isolated from Aspergillus, it exhibits inhibitory activity against hepatitis C protease.
Flemiflavanone D
6,8-Diprenyleriodictyol
paratocarpin G
(2S)-5,7,2,4-Tetrahydroxy-8-prenyl-5-(1,1-dimethylallyl)flavanone
remangiflavanone B
A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 2 and 4 and a lavandulyl group at position 8. Isolated from Physena madagascariensis, it exhibits antibacterial activity.
Exiguaflavanone A
A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 2 and 6 and a lavandulyl group at position 8. Isolated from Sophora exigua and Artemisia indica, it exhibits antimalarial activity.
Sanggenol A
Sanggenol A is a natural product found in Morus cathayana and Morus alba with data available.
norkurarinone
Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2]. Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2].
[(2R,3R,4S,5S,6R)-2-(acetyloxymethyl)-3,5-dihydroxy-6-[(2S,3R)-2,3,4-trihydroxybutoxy]oxan-4-yl] hexanoate
DIHYDROMUNDULETONE
Dihydromunduletone (DHM) is a rotenoid derivative and a selective, potent adhesion G protein-coupled receptor (aGPCR) (GPR56 and GPR114/ADGRG5) antagonist with an IC 50 of 20.9 μM for GPR56, but not inhibit GPR110 or class A GPCRs[1].
2-(3,5-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
(S)-Diplacone|6-geranyl-3,4,5,7-tetrahydroxy-flavanone|6-geranyl-3,4,5,7-tetrahydroxyflavanone|Diplacone|nymphaenol A|nymphaeol-A|nymphaerol A
1-(2,4-dihydroxyphenyl)-3-[8-hydroxy-2-methyl-2-(4-hydroxy-4-methyl-2-pentenyl)-2h-1-benzopyran-5-yl]-1-propanone
vexibinol
Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2]. Sophoraflavanone G (Kushenol F) is iaolated from Sophora flavescens and shows anti-tumor and anti-inflammatory properties.? Sophoraflavanone G (Kushenol F) induces MDA-MB-231 and HL-60 cells apoptosis through suppression of MAPK-related pathways[1][2].
(E)-2-hexenyl beta-D-sophoriside|(E)-2-Hexenyl-??-D-glucopyranosyl-(1鈥樏傗垎 2)-??-D-glucopyranoside
brasiliamide D|cis-1,4-diacetyl-2-benzyl-5-(3-methoxy-4,5-methylenedioxybenzyl)piperazine
8-(3,4-dihydroxyphenyl)-5-hydroxy-2,2-dimethyl-10-(3-methylbut-2-enyl)-3,4,7,8-tetrahydropyrano[3,2-g]chromen-6-one
2(S)-5,7-dihydroxy-5-prenyl-[2,2-(3-hydroxy)-dimethylpyrano]-(5,6:3,4)flavanone
(2R,3R)-3-geranyl-2,3-trans-5,7,4-trihydroxyflavonol
7,7-methanediylbis(3,4-dihydro-8-hydroxy-3,4,5-trimethyl-6H-isochromen-6-one)|dicitrinol|dicitrinone C
2,3,4,4-tetrahydroxy-3-[6-hydroxy-3,7-dimethyl-2(E),7-octadienyl]chalcone
N(1)-methoxycarbonyl-12-methoxy-Delta16,17-kopsinine
3,4,5,7-Tetrahydroxy-6,8-diprenyl-2,3-dihydroisoflavone
12-Methoxy-(-)-Kopsijasmine|N-methoxycarbonyl-12-methoxy-Delta16,17-kopsinine|N1-methoxycarbonyl-12-methoxy-Delta16,17-kopsinine
2-[3-(3-Methyl-2-butenyl)-4-hydroxyphenyl]-3,5,7-trihydroxy-8-(3-methyl-2-butenyl)-3,4-dihydro-2H-1-benzopyran-4-one
(Z)-3-hexenyl O-beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranoside
4,5,7-trihydroxy-6-[6-hydroxy-3,7-dimethyl-2,7-octadienyl]flavanone|mimolone B
5,4-dihydroxy-6-(3-methylbut-2-enyl)-5-hydroxyisopropyldihydrofurano[2,3:7,8]isoflavone|isosenegalensein
1,5-dihydroxy-3,8-dimethoxy-2-(3,3-dimethyl-2-propenyl)-7-(3,3-dimethyl-2-propenyl)xanthone|phylattrin
CRATOXYARBORENONE C
A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1 and 3, methoxy groups at positions 5 and 7 and two isoprenyl groups at positions 2 and 8 respectively. It is isolated from Cratoxylum Sumatranum and exhibits cytotoxicity towards the KB (human oral epidermoid) cancer cell line
(17R,19E)-17-acetoxy-1-acetyl-17,18-epoxy-11-methoxy-cur-19-ene|Condensamin|condensamine|Isocondensamin|isocondensamine
(+/-)-euchrestaflavanone B|(S)-form-Euchrestaflavanone B|5,7,2,4-tetrahydroxy-6,5-diprenylflavanone|cudraflavanone D|euchrestaflavanone B
3-(18,19-dihydro-19-hydroxygeranyloxy)-1,8-dihydroxy-6-methylanthraquinone|3-O-(3,7-dimethyl-7-hydroxyoct-2-enyl)-emodin
5-geranyl-3,4,5,7-tetrahydroxyflavanone|5,7,3,4-tetrahydroxy-5-C-geranylflavanone|isonymphaeol-B|propolin F
Schizolaenone C
Schizolaenone C is a natural product found in Paulownia tomentosa with data available.
5,7,4-trihydroxy-3-(7-hydroxy-3,7-dimethyl-2(E)-octenyl)isoflavone
KushenolE
Kushenol E is a natural product found in Flemingia prostrata, Maclura cochinchinensis, and other organisms with data available. See also: Sophora tonkinensis root (part of).
MEGxp0_000008
2-[3,4-Dihydroxy-2,5-bis(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one is a natural product found in Erythrina abyssinica and Erythrina latissima with data available.
Cathayanon H
Cathayanon H is a natural product found in Morus cathayana with data available.
3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
(2R,3R)-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
2-(3,4-dihydroxyphenyl)-6-[(2E)-3,7-dimethylocta-2,6-dienyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one
C18H32O11_(2E)-4-Hydroxy-3,4-dimethyl-2-penten-1-yl 6-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside
Benazepril
C - Cardiovascular system > C09 - Agents acting on the renin-angiotensin system > C09A - Ace inhibitors, plain > C09AA - Ace inhibitors, plain D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D000806 - Angiotensin-Converting Enzyme Inhibitors C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent C471 - Enzyme Inhibitor > C783 - Protease Inhibitor > C247 - ACE Inhibitor D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents
Novacine
A monoterpenoid indole alkaloid with formula C24H28N2O3, originallly isolated from the seeds of Strychnos nux-vomica.
3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one [IIN-based on: CCMSLIB00000846382]
3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one [IIN-based: Match]
Ala Ala Thr Tyr
Ala Ala Tyr Thr
Ala Phe Ser Thr
Ala Phe Thr Ser
Ala Ser Phe Thr
Ala Ser Thr Phe
Ala Thr Ala Tyr
Ala Thr Phe Ser
Ala Thr Ser Phe
Ala Thr Tyr Ala
Ala Tyr Ala Thr
Ala Tyr Thr Ala
Asp Pro Pro Pro
Phe Ala Ser Thr
Phe Ala Thr Ser
Phe Gly Thr Thr
Phe Ser Ala Thr
Phe Ser Thr Ala
Phe Thr Ala Ser
Phe Thr Gly Thr
Phe Thr Ser Ala
Phe Thr Thr Gly
Gly Phe Thr Thr
Gly Ser Val Tyr
Gly Ser Tyr Val
Gly Thr Phe Thr
Gly Thr Thr Phe
Gly Val Ser Tyr
Gly Val Tyr Ser
Gly Tyr Ser Val
Gly Tyr Val Ser
Pro Asp Pro Pro
Pro Pro Asp Pro
Pro Pro Pro Asp
Ser Ala Phe Thr
Ser Ala Thr Phe
Ser Phe Ala Thr
Ser Phe Thr Ala
Ser Gly Val Tyr
Ser Gly Tyr Val
Ser Thr Ala Phe
Ser Thr Phe Ala
Ser Val Gly Tyr
Ser Val Tyr Gly
Ser Tyr Gly Val
Ser Tyr Val Gly
Thr Ala Ala Tyr
Thr Ala Phe Ser
Thr Ala Ser Phe
Thr Ala Tyr Ala
Thr Phe Ala Ser
Thr Phe Gly Thr
Thr Phe Ser Ala
Thr Phe Thr Gly
Thr Gly Phe Thr
Thr Gly Thr Phe
Thr Ser Ala Phe
Thr Ser Phe Ala
Thr Thr Phe Gly
Thr Thr Gly Phe
Thr Tyr Ala Ala
Val Gly Ser Tyr
Val Gly Tyr Ser
Val Ser Gly Tyr
Val Ser Tyr Gly
Val Tyr Gly Ser
Val Tyr Ser Gly
Tyr Ala Ala Thr
Tyr Ala Thr Ala
Tyr Gly Ser Val
Tyr Gly Val Ser
Tyr Ser Gly Val
Tyr Ser Val Gly
Tyr Thr Ala Ala
Tyr Val Gly Ser
Tyr Val Ser Gly
Sigmoidin A
A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 3 and 4 and prenyl groups at positions 2 and 5. Isolated from Erythrina sigmoidea, it exhibits anti-inflammatory and antioxidant activities.
β-Mangostin
beta-Mangostin (β-Mangostin) is a xanthone compound present in Cratoxylum arborescens, with antibacterial and antimalarial activities. beta-Mangostin exhibits antimycobacterial activity against Mycobacterium tuberculosis with an MIC of 6.25 μg/mL. beta-Mangostin possesses in vitro antimalarial activity against Plasmodium falciparum, with an IC50 of 3.00 μg/mL. beta-Mangostin has potent anticancer activity against various cancers (such as hepatocellular carcinoma, leukaemic)[1][2][3][4]. beta-Mangostin (β-Mangostin) is a xanthone compound present in Cratoxylum arborescens, with antibacterial and antimalarial activities. beta-Mangostin exhibits antimycobacterial activity against Mycobacterium tuberculosis with an MIC of 6.25 μg/mL. beta-Mangostin possesses in vitro antimalarial activity against Plasmodium falciparum, with an IC50 of 3.00 μg/mL. beta-Mangostin has potent anticancer activity against various cancers (such as hepatocellular carcinoma, leukaemic)[1][2][3][4].
3-Methyl-2-butenyl-(-)-piperitol
1,7-Dihydroxy-3,6-dimethoxy-2,8-diprenylxanthone
2,2-dimethylpropane-1,3-diol,ethane-1,2-diol,propane-1,2,3-triol,terephthalic acid
sodium 2-[2-[2-(octylphenoxy)ethoxy]ethoxy]ethanesulphonate
sodium 2-[2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethoxy]ethanesulphonate
Unii-QI52W1ziib
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor > C155764 - AKT Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor
nymphaeol B
A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy group at positions 5, 7, 3 and 4 and a geranyl group at position 2. Isolated from Macaranga tanarius and propolis collected in Okinawa, it exhibits radical scavenging activity.
2-[3-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid
7-Hydroxy-8-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-3-(2-methoxyphenyl)-2-methyl-1-benzopyran-4-one
3-[3-(N-ethylanilino)propyl]-6-(4-morpholinyl)-2-sulfanylidene-1H-quinazolin-4-one
2-(3,5-Dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
Nymphaeol A
A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy group at positions 5, 7, 3 and 4 and a geranyl group at position 6. Isolated from Macaranga tanarius and propolis collected in Okinawa, it exhibits radical scavenging activity.
(2S,3S,6R)-3-[[(3S)-3-azaniumyl-5-[diaminomethylidene(methyl)azaniumyl]pentanoyl]amino]-6-(2,4-dioxopyrimidin-1-yl)-3,6-dihydro-2H-pyran-2-carboxylate
[(3S)-3-amino-5-[[(2S,3S,6R)-2-carboxy-6-(2,4-dioxopyrimidin-1-yl)-3,6-dihydro-2H-pyran-3-yl]amino]-5-oxopentyl]-(diaminomethylidene)-methylazanium
(2S)-5,7,3,5-tetrahydroxy-8-[3,8-dimethylocta-2(E),7-dienyl]flavonone
A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 3 and 5 and a geranyl group at position 8. Isolated from Macaranga bicolor, it exhibits inhibitory activity against breast cancer resistance protein.
Isonymphaeol B
A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 3 and 4 and a geranyl group at position 5. Isolated from Propolis from Okinawa, Japan, it exhibits radical scavenging activity.
1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-cyclohexylmethylidene]-5-(4-ethoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Ala-Phe-Thr-Ser
A tetrapeptide composed of L-alanine, L-phenylalanine, L-threonine, and L-serine joined in sequence by peptide linkages.
3-(4-methoxyphenyl)-2-(4-methyl-1-piperazinyl)-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidin-4-one
Ethyl 1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-1-phenylethyl]piperidine-4-carboxylate
1,7-Bis(3,4-dimethoxyphenyl)-4,4-dimethylhepta-1,6-diene-3,5-dione
(1S,5R)-7-[4-(3-cyanophenyl)phenyl]-N-(2-methoxyphenyl)-3,6-diazabicyclo[3.1.1]heptane-3-carboxamide
(1R)-N-(2-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]carboxamide
(1S)-N-(2-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]carboxamide
arugosin A (hydroxy-aldehyde form)
A member of the class of benzophenones that is benzophenone in which one of the phenyl groups is substituted by a 3,3-dimethylallyl group at position 3 and by hydroxy groups at positions 2 and 6, while the other is substituted by a formyl group at position 2, a 3,3-dimethylallyloxy group at position 3, a methyl group at position 4, and a hydroxy group at position 6.
[3-amino-5-[[(2S,3S,6R)-2-carboxy-6-(2,4-dioxopyrimidin-1-yl)-3,6-dihydro-2H-pyran-3-yl]amino]-5-oxopentyl]-(diaminomethylidene)-methylazanium
Lys-Asp-Tyr
A tripeptide composed of L-lysine, L-aspartic acid and L-tyrosine joined in sequence by peptide linkages.
(S)-2-(3,5-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)chroman-4-one
A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5, 7, 3 and 5 and prenyl groups at positions 6 and 8 respectively. It has been isolated from natural product found in Macaranga conifera.
deaminohydroxyblasticidin S(1+)
Conjugate acid of deaminohydroxyblasticidin S having an anionic carboxy group and protonated primary amino and guanidino groups; major species at pH 7.3.
5-LOX-IN-4
5-LOX-IN-4 is a 5-Lipoxygenase inhibitor extracted from patent EP 331232 A2, table 4, compound example 4.10.
(2s)-2-(2,4-dihydroxyphenyl)-8-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one
3-(2,4-dihydroxyphenyl)-8-[(2z)-3,7-dimethylocta-2,6-dien-1-yl]-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one
7,11-dihydroxy-17-(2-hydroxypropan-2-yl)-13-methyl-6-(3-methylbut-2-en-1-yl)-2,15-dioxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-3,5,7,10,12,14(18)-hexaen-9-one
(2s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis[(1e)-3-methylbut-1-en-1-yl]-2,3-dihydro-1-benzopyran-4-one
(2s,4ar,5s)-2,8,10-trihydroxy-2,5-dimethyl-5-(4-methylpent-3-en-1-yl)-4,4a-dihydro-3h-6-oxatetraphene-7,12-dione
(2r,9s,13s,15r,17r,25r)-21,22-dimethoxy-17-methyl-12,19-dioxa-5,16-diazaheptacyclo[14.7.1.1²,⁵.0²,¹⁵.0⁹,¹³.0²⁰,²⁴.0⁹,²⁵]pentacosa-1(24),7,20,22-tetraen-11-one
(3r)-2,2-dimethyl-5,10-dioxo-3h,4h-naphtho[2,3-b]pyran-3-yl (2e,6s)-6-hydroxy-2,6-dimethylocta-2,7-dienoate
1,8-dihydroxy-3-{[(2e)-7-hydroxy-3,7-dimethyloct-2-en-1-yl]oxy}-6-methylanthracene-9,10-dione
(3r)-3-{5-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-2,4-dihydroxyphenyl}-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one
5,7-dihydroxy-2-[3-hydroxy-2,2-dimethyl-8-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-6-yl]-2,3-dihydro-1-benzopyran-4-one
(2s)-2-(2,4-dihydroxyphenyl)-8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one
(2r,11r,16s,17s)-17-methyl-17-(4-methylpent-3-en-1-yl)-4,12,18-trioxapentacyclo[11.8.0.0²,¹¹.0⁵,¹⁰.0¹⁴,¹⁹]henicosa-1(21),5,7,9,13,19-hexaene-7,16,20-triol
(2s)-5,7-dihydroxy-2-[4-hydroxy-3-(2-hydroxy-3-methylbut-3-en-1-yl)-5-(3-methylbut-2-en-1-yl)phenyl]-2,3-dihydro-1-benzopyran-4-one
(2z)-3-hydroxy-1-[(2s)-6-hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-en-1-one
(1s,17s)-7,11-dihydroxy-17-(2-hydroxypropan-2-yl)-13-methyl-6-(3-methylbut-2-en-1-yl)-2,15-dioxatetracyclo[8.7.1.0³,⁸.0¹⁴,¹⁸]octadeca-3,5,7,10,12,14(18)-hexaen-9-one
3-(2,4-dihydroxyphenyl)-3,7-dihydroxy-6,8-bis(3-methylbut-2-en-1-yl)-2h-1-benzopyran-4-one
(2-{[(1r,2s,4as)-1,2,4a-trimethyl-5-methylidene-hexahydro-2h-naphthalen-1-yl]methyl}-6-hydroxy-4-(hydroxymethyl)phenyl)oxidanesulfonic acid
(3s)-3-(2,4-dihydroxyphenyl)-8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one
(4s,12r)-8-hydroxy-12-(4-hydroxyphenyl)-4-(2-hydroxypropan-2-yl)-7-(3-methylbut-2-en-1-yl)-5,13-dioxatricyclo[7.4.0.0²,⁶]trideca-1(9),2(6),7-trien-10-one
(2s)-2-{5-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-2,4-dihydroxyphenyl}-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one
(3s)-3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-2-en-1-yl)-2,3-dihydro-1-benzopyran-4-one
(10s)-4,10,15-trihydroxy-13-methyl-7-(3-methylbut-2-en-1-yl)-12-[(3-methylbut-2-en-1-yl)oxy]-9-oxatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaen-2-one
3-(2,4-dihydroxyphenyl)-8-(3,7-dimethylocta-2,6-dien-1-yl)-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one
(2s)-2-[2,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-5,7-dihydroxy-6-(3-methylbut-2-en-1-yl)-2,3-dihydro-1-benzopyran-4-one
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6,8-bis(3-methylbut-1-en-1-yl)-2,3-dihydro-1-benzopyran-4-one
(2r,11r,16r,17r)-17-methyl-17-(4-methylpent-3-en-1-yl)-4,12,18-trioxapentacyclo[11.8.0.0²,¹¹.0⁵,¹⁰.0¹⁴,¹⁹]henicosa-1(21),5,7,9,13,19-hexaene-7,16,20-triol
8-hydroxy-12-(4-hydroxyphenyl)-5-(2-hydroxypropan-2-yl)-2-(3-methylbut-2-en-1-yl)-4,13-dioxatricyclo[7.4.0.0³,⁷]trideca-1(9),2,7-trien-10-one
(2s)-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2s)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]-2,3-dihydro-1-benzopyran-4-one
(2s)-2-(2,6-dihydroxyphenyl)-5,7-dihydroxy-8-[(2s)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]-2,3-dihydro-1-benzopyran-4-one
8-hydroxy-7-[(8-hydroxy-3,4,5-trimethyl-6-oxo-3,4-dihydro-2-benzopyran-7-yl)methyl]-3,4,5-trimethyl-3,4-dihydro-2-benzopyran-6-one
(5r,12s)-8-hydroxy-12-(4-hydroxyphenyl)-5-(2-hydroxypropan-2-yl)-2-(3-methylbut-2-en-1-yl)-4,13-dioxatricyclo[7.4.0.0³,⁷]trideca-1(9),2,7-trien-10-one
3-(4-hydroxyphenyl)-7-methoxy-5-{[(2s,3r,4r,5r,6s)-3,4,5,6-tetramethyloxan-2-yl]oxy}chromen-4-one
(2r,3r)-2-{3-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-4-hydroxyphenyl}-3,5,7-trihydroxy-2,3-dihydro-1-benzopyran-4-one
5-(3,4-dihydroxyphenyl)-9-hydroxy-13,13-dimethyl-2-(3-methylbut-2-en-1-yl)-4,14-dioxatricyclo[8.4.0.0³,⁸]tetradeca-1,3(8),9-trien-7-one
5,7-dihydroxy-3-{4-hydroxy-3-[(2e)-7-hydroxy-3,7-dimethyloct-2-en-1-yl]phenyl}chromen-4-one
(2s,5ar,9as)-2-(3,4-dihydroxyphenyl)-5-hydroxy-8,8-dimethyl-10-(3-methylbut-2-en-1-yl)-2h,3h,5ah,9ah-pyrano[3,2-g]chromen-4-one
1,3-dihydroxy-6,7-dim ethoxy-2,8-diprenylxan-thone
{"Ingredient_id": "HBIN001194","Ingredient_name": "1,3-dihydroxy-6,7-dim ethoxy-2,8-diprenylxan-thone","Alias": "NA","Ingredient_formula": "C25H28O6","Ingredient_Smile": "CC(=CCC1=C(C(=C2C(=C1)C(=O)C3=C(C(=C(C=C3O2)OC)CC=C(C)C)O)O)OC)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5826","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2',3,4,4'-tetrahydroxy-3'-[6-hydroxy-3,7-di-methyl-2(e),7-octadienyl]chalcone
{"Ingredient_id": "HBIN003850","Ingredient_name": "2',3,4,4'-tetrahydroxy-3'-[6-hydroxy-3,7-di-methyl-2(e),7-octadienyl]chalcone","Alias": "NA","Ingredient_formula": "C25H28O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21103","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2R)-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S)-2-isopropenyl-5-methylhex-4-enyl]-4-chromanone
{"Ingredient_id": "HBIN006360","Ingredient_name": "(2R)-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S)-2-isopropenyl-5-methylhex-4-enyl]-4-chromanone","Alias": "(2R)-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S)-5-methyl-2-prop-1-en-2-ylhex-4-enyl]chroman-4-one; (2R)-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S)-5-methyl-2-prop-1-en-2-yl-hex-4-enyl]chroman-4-one; (2R)-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S)-2-isopropenyl-5-methyl-hex-4-enyl]chroman-4-one; ZINC02008845","Ingredient_formula": "C25H28O6","Ingredient_Smile": "NA","Ingredient_weight": "424.49","OB_score": "1.220421641","CAS_id": "34981-24-3","SymMap_id": "SMIT08216","TCMID_id": "NA","TCMSP_id": "MOL006631","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2r,3r)-lespedezaflavanone c
{"Ingredient_id": "HBIN006454","Ingredient_name": "(2r,3r)-lespedezaflavanone c","Alias": "NA","Ingredient_formula": "C25H28O6","Ingredient_Smile": "CC(=CCC1=C(C=CC(=C1)C2C(C(=O)C3=C(C=C(C(=C3O2)CC=C(C)C)O)O)O)O)C","Ingredient_weight": "424.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "12675","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "14542252","DrugBank_id": "NA"}
3'-(γ,γ-dimethylallyl)-kievitone
{"Ingredient_id": "HBIN009773","Ingredient_name": "3'-(\u03b3,\u03b3-dimethylallyl)-kievitone","Alias": "3'(\u03b3,\u03b3-dimethylallyl)-kievitone","Ingredient_formula": "C25H28O6","Ingredient_Smile": "CC(=CCC1=C(C=CC(=C1O)C2COC3=C(C2=O)C(=CC(=C3CC=C(C)C)O)O)O)C","Ingredient_weight": "424.53","OB_score": "1.211793727","CAS_id": "NA","SymMap_id": "SMIT00880","TCMID_id": "6306","TCMSP_id": "MOL004965","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
β-mangostin
{"Ingredient_id": "HBIN018187","Ingredient_name": "\u03b2-mangostin","Alias": "NA","Ingredient_formula": "C25H28O6","Ingredient_Smile": "CC(=CCC1=C(C=C2C(=C1O)C(=O)C3=C(C(=C(C=C3O2)O)OC)CC=C(C)C)OC)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13486","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
