Exact Mass: 550.1998
Exact Mass Matches: 550.1998
Found 500 metabolites which its exact mass value is equals to given mass value 550.1998
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Genipin
Genipin 1-beta-gentiobioside is a terpene glycoside. Genipin 1-gentiobioside is a natural product found in Gardenia jasminoides and Genipa americana with data available. Genipin 1-β-D-gentiobioside (Genipin 1-gentiobioside) is one of the most abundant and bioactive iridoid glycosides in Gardenia jasminoides Ellis, which possesses hepatoprotective, anti-inflammatory, antioxidant, and antithrombotic activities. Genipin 1-β-D-gentiobioside (Genipin 1-gentiobioside) is one of the most abundant and bioactive iridoid glycosides in Gardenia jasminoides Ellis, which possesses hepatoprotective, anti-inflammatory, antioxidant, and antithrombotic activities.
Eucommin A
Liquiritin apioside
Liquiritin apioside is found in herbs and spices. Liquiritin apioside is found in Glycyrrhiza uralensis (Chinese licorice) and Glycyrrhiza glabra (licorice). Found in Glycyrrhiza uralensis (Chinese licorice) and Glycyrrhiza glabra (licorice) Liquiritin apioside, a main flavonoid component of licorice, possesses antitussive effects[1]. Liquiritin apioside, a main flavonoid component of licorice, possesses antitussive effects[1].
Neolicuroside
Neolicuroside is found in herbs and spices. Neolicuroside is a constituent of Glycyrrhiza uralensis (Chinese licorice). Constituent of Glycyrrhiza uralensis (Chinese licorice). Neolicuroside is found in herbs and spices. Isoliquiritin apioside significantly decreases PMA-induced increases in MMP9 activities and suppresses PMA-induced activation of MAPK and NF-κB. Isoliquiritin apioside auppresseses invasiveness and angiogenesis of cancer cells and endothelial cells[1]. Isoliquiritin apioside significantly decreases PMA-induced increases in MMP9 activities and suppresses PMA-induced activation of MAPK and NF-κB. Isoliquiritin apioside auppresseses invasiveness and angiogenesis of cancer cells and endothelial cells[1].
Tracheloside
Constituent of Carthamus tinctorius (safflower). Tracheloside is found in safflower, fats and oils, and herbs and spices. Tracheloside is found in fats and oils. Tracheloside is a constituent of Carthamus tinctorius (safflower) Tracheloside is an antiestrogenic lignin. Tracheloside promotes keratinocyte proliferation through ERK1/2 stimulation. Tracheloside is a good candidate to promote wound healing[1]. Tracheloside is an antiestrogenic lignin. Tracheloside promotes keratinocyte proliferation through ERK1/2 stimulation. Tracheloside is a good candidate to promote wound healing[1].
Scorzonoside
Constituent of Scorzonera hispanica (scorzonera). Scorzonoside is found in coffee and coffee products and root vegetables. Scorzonoside is found in coffee and coffee products. Scorzonoside is a constituent of Scorzonera hispanica (scorzonera).
4'-Hydroxyacetophenone 4'-[4-hydroxybenzoyl-(->5)-apiosyl-(1->2)-glucoside]
4-Hydroxyacetophenone 4-[4-hydroxybenzoyl-(->5)-apiosyl-(1->2)-glucoside] is found in herbs and spices. 4-Hydroxyacetophenone 4-[4-hydroxybenzoyl-(->5)-apiosyl-(1->2)-glucoside] is a constituent of Thymus vulgaris (thyme) Constituent of Thymus vulgaris (thyme). 4-Hydroxyacetophenone 4-[4-hydroxybenzoyl-(->5)-apiosyl-(1->2)-glucoside] is found in herbs and spices.
Castavinol
Castavinol is found in alcoholic beverages. Castavinol is isolated from a Bordeaux red win
Neoliquiritin 2'-apioside
Neoliquiritin 2-apioside is found in herbs and spices. Neoliquiritin 2-apioside is a constituent of Glycyrrhiza glabra (licorice). Constituent of Glycyrrhiza glabra (licorice). Neoliquiritin 2-apioside is found in tea and herbs and spices. Liquiritigenin-7-O-β-D-glucopyranosyl-(1→2)-β-D-apiofuranoside (Liquiritigenin-7-apiosylglucoside) is a flavonoid isolated from the roots of Glycyrrhiza, has weaker cytotoxicity against several tumor cells and normal cells[1].
Hydroxymatairesinol glucuronide 1
Caspase-3 Inhibitor III
Genipin 1-gentiobioside
Isoliquiritin apioside
Lappaol B
Lappaol b is a member of the class of compounds known as 2-arylbenzofuran flavonoids. 2-arylbenzofuran flavonoids are phenylpropanoids containing the 2-phenylbenzofuran moiety. Lappaol b is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Lappaol b can be found in burdock, which makes lappaol b a potential biomarker for the consumption of this food product.
2-Hydroxyarctiin
2-hydroxyarctiin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 2-hydroxyarctiin can be found in safflower, which makes 2-hydroxyarctiin a potential biomarker for the consumption of this food product.
Neolicuroside
Neolicuroside is a member of flavonoids and a glycoside. Isoliquiritin apioside is a natural product found in Glycyrrhiza uralensis with data available. Isoliquiritin apioside significantly decreases PMA-induced increases in MMP9 activities and suppresses PMA-induced activation of MAPK and NF-κB. Isoliquiritin apioside auppresseses invasiveness and angiogenesis of cancer cells and endothelial cells[1]. Isoliquiritin apioside significantly decreases PMA-induced increases in MMP9 activities and suppresses PMA-induced activation of MAPK and NF-κB. Isoliquiritin apioside auppresseses invasiveness and angiogenesis of cancer cells and endothelial cells[1].
Liquiritin apioside
Liquiritin apioside is a member of flavonoids and a glycoside. Liquiritin apioside is a natural product found in Paeonia lactiflora, Glycyrrhiza glabra, and other organisms with data available. See also: Glycyrrhiza uralensis Root (part of). Liquiritin apioside, a main flavonoid component of licorice, possesses antitussive effects[1]. Liquiritin apioside, a main flavonoid component of licorice, possesses antitussive effects[1].
Tracheloside
Tracheloside is a glycoside and a lignan. It has a role as a metabolite. Tracheloside is a natural product found in Carthamus oxyacanthus, Trachelospermum asiaticum, and other organisms with data available. A natural product found particularly in Carthamus tinctorius and Trachelospermum. Tracheloside is an antiestrogenic lignin. Tracheloside promotes keratinocyte proliferation through ERK1/2 stimulation. Tracheloside is a good candidate to promote wound healing[1]. Tracheloside is an antiestrogenic lignin. Tracheloside promotes keratinocyte proliferation through ERK1/2 stimulation. Tracheloside is a good candidate to promote wound healing[1].
Liguiritigenin-7-O-D-apiosyl-4-O-D-glucoside
Liguiritigenin-7-O-beta-D-apiosyl-4-O-beta-D-glucoside is a member of flavonoids and a glycoside. Liguiritigenin-7-O-D-apiosyl-4'-O-D-glucoside is a flavanone glycoside isolated from Glycyrrhizia inflate[1].
Jasminoside
Rel-5-Hydroxy-7,4-dimethoxy-3S-(2,4,5-trimethoxy-Estyryl)tetrahydrofuro[4R,5R:2,3]flavanonol
Mortonol B
Chalconaringenin 2-rhamnosyl- (1->4) -xyloside
Rel-5-hydroxy-7,4-dimethoxy-2S-(2,4,5-trimethoxy-E-styryl)-tetrahydrofuro[4R,5R:2,3]flavanonol
Liquiritigenin 7-apiofuranoside-4-glucoside
Liguiritigenin-7-O-D-apiosyl-4'-O-D-glucoside is a flavanone glycoside isolated from Glycyrrhizia inflate[1].
Licuroside
Licraside is isolated from Glycyrrhiza uralesis Fish. Licraside is isolated from Glycyrrhiza uralesis Fish.
Liquiritin apioside
Liquiritin apioside, a main flavonoid component of licorice, possesses antitussive effects[1]. Liquiritin apioside, a main flavonoid component of licorice, possesses antitussive effects[1].
(Z)--3-(2-(4-hydroxy-3-(3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-1-oxopropan-2-yl)-5-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydrobenzofuran-5-yl)acrylaldehyde|herpepropenal
methyl (1S,5R)-1-[(beta-D-glucopyranosyl)oxy]-1,4a,5,7a-tetrahydro-5-hydroxy-7-{[(alpha-L-rhamnopyranosyl)oxy]methyl}cyclopenta[c]pyran-4-carboxylate|teneoside B
obochalcolactone
A member of the class of chalcones isolated from the trunk barks of Cryptocarya obovata and has been shown to exhibit cytotoxicity against the KB cell line.
10-O-beta-D-glucopyranosyl geniposide|genameside D|genipin 1,10-di-O-beta-D-glucopyranoside
3-O-benzoyl-beta-D-fructofuranosyl 4-O-benzoyl-alpha-D-glucopyranoside|telephiose F
10-O-coumaroyl-10-O-deacetyldaphylloside|methyl(1S,4aS,5S,7aS)-1-(beta-D-glucopyranosyloxy)-1,4a,5,7a,-tetrahydro-5-hydroxy-7-{{[(2E)-3-(4-hydroxyphenyl)-1-oxoprop-2-enyl]oxy}methyl}cyclopenta[c]pyran-4-carboxylate
6-(3-hydroxy-3-methylbutyl)quercetin 7-O-beta-D-glucoside
4-[beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranosyloxy]-3-(methoxyphenyl)propiophenone
(2S)-pinocembrin 7-O-[beta-D-apiosyl(1->2)]-beta-D-glucoside|(2S)-Pinocembrin 7-O-[??-D-apiosyl(1鈥樏傗垎2)]-??-D-glucoside|(2S)-pinocembrin-7-O-[apiosyl(1->2)]-glucoside|pinocembrin 7-O-[beta-D-apiofuranosyl(1-2)-beta-D-glucopyranoside]
(2E)-1-{2,4-dihydroxy-3-[(1R,2E,5R)-5-hydroxy-1-(4-hydroxyphenyl)-7-phenyl-2-hepten-1-yl]-6-methoxyphenyl}-3-phenyl-2-propen-1-one|Alpinnanin B|ent-alpinnanin B
3,3,5-trimethoxy-4,7-epoxy-8,5-neolign-7-ene-4,9,9-triol 9-beta-D-glucopyranoside|[2-(4-hydroxy-3,5-dimethoxyphenyl)-5-(3-hydroxypropyl)-7-methoxybenzofuran-3-yl]methyl beta-D-glucopyranoside
desmethylyangonine-4-O-(6-O-(3-hydroxy-3-methyl)glutaryl)-beta-D-glucopyranoside
Pinocembrin-7-O-??-arabinopyranosyl-(1鈥樏傗垎2)-??-glucopyranoside
7-hydroxy-8-(4-cinnamoyl-3-methyl-1-oxobutyl)-4-phenyl-2,2-dimethyl-2H,6H-benzo[1.2-b:3,4-b]-dipyran-2-one
(5R,6R,8S,9R,10S,12S)-15,16-epoxy-2-oxo-6-O-(beta-D-glucopyranosyl)-cleroda-3,13(16),14-trien-17,12-olid-18-oic acid methyl ester
5-methoxy-(E)-resveratrol 3-O-rutinoside|trans-4,5-dihydroxy-3-methoxystilbene-5-O-[alpha-L-rhamnopyranosyl-(1->6)]-beta-D-glucopyranoside
1, 1-[[2, 4-Bis(6-methoxy-1, 3-benzodioxol-5-yl)-1, 3-cyclobutanediyl]dicarbonyl]bispyrrolidine, 9CI
5-hydroxy-6-(4-cinnamoyl-3-methyl-1-oxobutyl)-4-phenyl-2,2-dimethyl-2H,6H-benzo[1.2-b:3,4-b]-dipyran-2-one
Liquiritigenin-7-apiosylglucoside
Liquiritigenin-7-O-β-D-glucopyranosyl-(1→2)-β-D-apiofuranoside (Liquiritigenin-7-apiosylglucoside) is a flavonoid isolated from the roots of Glycyrrhiza, has weaker cytotoxicity against several tumor cells and normal cells[1].
Licurazid
Licuraside is a natural product found in Glycyrrhiza glabra, Glycyrrhiza uralensis, and other organisms with data available. See also: Glycyrrhiza Glabra (part of). Licraside is isolated from Glycyrrhiza uralesis Fish. Licraside is isolated from Glycyrrhiza uralesis Fish.
2-[4-[3-[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7-hydroxy-2,3-dihydrochromen-4-one
(4S,5Z,6S)-4-(2-methoxy-2-oxoethyl)-5-[2-[(E)-3-phenylprop-2-enoyl]oxyethylidene]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid
Genipin-gentiobioside
Genipin 1-β-D-gentiobioside (Genipin 1-gentiobioside) is one of the most abundant and bioactive iridoid glycosides in Gardenia jasminoides Ellis, which possesses hepatoprotective, anti-inflammatory, antioxidant, and antithrombotic activities. Genipin 1-β-D-gentiobioside (Genipin 1-gentiobioside) is one of the most abundant and bioactive iridoid glycosides in Gardenia jasminoides Ellis, which possesses hepatoprotective, anti-inflammatory, antioxidant, and antithrombotic activities.
Isoliquiritin apioside
Isoliquiritin apioside significantly decreases PMA-induced increases in MMP9 activities and suppresses PMA-induced activation of MAPK and NF-κB. Isoliquiritin apioside auppresseses invasiveness and angiogenesis of cancer cells and endothelial cells[1]. Isoliquiritin apioside significantly decreases PMA-induced increases in MMP9 activities and suppresses PMA-induced activation of MAPK and NF-κB. Isoliquiritin apioside auppresseses invasiveness and angiogenesis of cancer cells and endothelial cells[1].
Genipin 1-gentiobioside
Genipin 1-β-D-gentiobioside (Genipin 1-gentiobioside) is one of the most abundant and bioactive iridoid glycosides in Gardenia jasminoides Ellis, which possesses hepatoprotective, anti-inflammatory, antioxidant, and antithrombotic activities. Genipin 1-β-D-gentiobioside (Genipin 1-gentiobioside) is one of the most abundant and bioactive iridoid glycosides in Gardenia jasminoides Ellis, which possesses hepatoprotective, anti-inflammatory, antioxidant, and antithrombotic activities.
C26H30O13_1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-4,4a,5,6-tetrahydro-4a-hydroxy-6-[[3-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propen-1-yl]-beta-D-glucopyranosyl]oxy]-, (4aR,5R,6S)
C26H30O13_2H-Pyran-4-acetic acid, 5-carboxy-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-3-[2-[[(2Z)-1-oxo-3-phenyl-2-propen-1-yl]oxy]ethylidene]-, alpha-methyl ester, (2S,3Z,4S)
2-[4-[3-[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7-hydroxy-2,3-dihydrochromen-4-one
(4S,5Z,6S)-4-(2-methoxy-2-oxoethyl)-5-[2-[(E)-3-phenylprop-2-enoyl]oxyethylidene]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid
(4S,5Z,6S)-4-(2-methoxy-2-oxoethyl)-5-[2-[(E)-3-phenylprop-2-enoyl]oxyethylidene]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid [IIN-based on: CCMSLIB00000845476]
(4S,5Z,6S)-4-(2-methoxy-2-oxoethyl)-5-[2-[(E)-3-phenylprop-2-enoyl]oxyethylidene]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid [IIN-based: Match]
2-[4-[3-[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7-hydroxy-2,3-dihydrochromen-4-one [IIN-based on: CCMSLIB00000848134]
2-[4-[3-[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7-hydroxy-2,3-dihydrochromen-4-one [IIN-based: Match]
(4S,5Z,6S)-4-(2-methoxy-2-oxoethyl)-5-[2-[(E)-3-phenylprop-2-enoyl]oxyethylidene]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid [IIN-based on: CCMSLIB00000845474]
Cys Asp Lys Trp
Cys Asp Gln Trp
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Cys Glu His Tyr
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Cys Gly Trp Trp
Cys His Glu Tyr
Cys His Tyr Glu
Cys Lys Asp Trp
Cys Lys Trp Asp
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Cys Asn Trp Glu
Cys Gln Asp Trp
Cys Gln Trp Asp
Cys Arg Ser Trp
Cys Arg Trp Ser
Cys Ser Arg Trp
Cys Ser Trp Arg
Cys Trp Asp Lys
Cys Trp Asp Gln
Cys Trp Glu Asn
Cys Trp Gly Trp
Cys Trp Lys Asp
Cys Trp Asn Glu
Cys Trp Gln Asp
Cys Trp Arg Ser
Cys Trp Ser Arg
Cys Trp Trp Gly
Cys Tyr Glu His
Cys Tyr His Glu
Asp Cys Lys Trp
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Glu Cys His Tyr
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Glu His Glu His
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Glu Asn Trp Cys
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Glu Trp Asn Cys
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Gly Trp Cys Trp
Gly Trp Trp Cys
His Cys Glu Tyr
His Cys Tyr Glu
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His His Glu Glu
His Met Thr Tyr
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His Tyr Cys Glu
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Lys Cys Asp Trp
Lys Cys Trp Asp
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Met His Thr Tyr
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Asn Cys Glu Trp
Asn Cys Trp Glu
Asn Glu Cys Trp
Asn Glu Trp Cys
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Asn Met Trp Thr
Asn Thr Met Trp
Asn Thr Trp Met
Asn Trp Cys Glu
Asn Trp Glu Cys
Asn Trp Met Thr
Asn Trp Thr Met
Gln Cys Asp Trp
Gln Cys Trp Asp
Gln Asp Cys Trp
Gln Asp Trp Cys
Gln Met Ser Trp
Gln Met Trp Ser
Gln Ser Met Trp
Gln Ser Trp Met
Gln Trp Cys Asp
Gln Trp Asp Cys
Gln Trp Met Ser
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Arg Cys Ser Trp
Arg Cys Trp Ser
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Ser Cys Trp Arg
Ser Met Gln Trp
Ser Met Trp Gln
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Thr His Met Tyr
Thr His Tyr Met
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Thr Met Trp Asn
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Thr Asn Trp Met
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Thr Tyr Met His
Trp Cys Asp Lys
Trp Cys Asp Gln
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Trp Cys Trp Gly
Trp Asp Cys Lys
Trp Asp Cys Gln
Trp Asp Lys Cys
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Trp Glu Cys Asn
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Trp Gly Trp Cys
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Trp Asn Cys Glu
Trp Asn Glu Cys
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Trp Ser Gln Met
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Trp Thr Asn Met
Trp Trp Cys Gly
Trp Trp Gly Cys
Tyr Cys Glu His
Tyr Cys His Glu
Tyr Glu Cys His
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Tyr His Met Thr
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Tyr Thr Met His
Pluripotin
Castavinol
4'-Hydroxyacetophenone 4'-[4-hydroxybenzoyl-(->5)-apiosyl-(1->2)-glucoside]
Scorzonoside
Liquiritigenin-7-O-β-D-glucopyranosyl-(1→2)-β-D-apiofuranoside
Liquiritigenin-7-O-β-D-glucopyranosyl-(1→2)-β-D-apiofuranoside (Liquiritigenin-7-apiosylglucoside) is a flavonoid isolated from the roots of Glycyrrhiza, has weaker cytotoxicity against several tumor cells and normal cells[1]. Liquiritigenin-7-O-β-D-glucopyranosyl-(1→2)-β-D-apiofuranoside. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=135432-48-3 (retrieved 2024-10-18) (CAS RN: 135432-48-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
1,2-bis(dicyclohexylphosphino)ethane nickel(ii) chloride
2-Methyl-2-propanyl 4-[1-(phenylsulfonyl)-3-(4,4,5,5-tetramethyl- 1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1H-pyrazo le-1-carboxylate
(6,6-dimethyl-[1,1-biphenyl]-2,2-diyl)bis(diphenylphosphine)
3-methoxy-6-(4-methoxyphenyl)-6-phenyl-Dibenzo[3,4:7,8]fluoreno[2,1-b]pyran-9(6H)-one
(11aR)-3,7-Bis(2,4,6-trimethylphenyl)-10,11,12,13-tetrahydro-5-hydroxy-5-oxide-diindeno[7,1-de:1,7-fg][1,3,2]dioxaphosphocin
(4R,8R,11S,18S)-4-benzyl-18-[(2S)-butan-2-yl]-11-methyl-6,13-dioxa-20-thia-3,10,17,22,23,24-hexazatetracyclo[17.2.1.15,8.112,15]tetracosa-1(21),5(24),12(23),14,19(22)-pentaene-2,9,16-trione
4-(2-Methoxy-2-oxoethyl)-5-[2-(3-phenylprop-2-enoyloxy)ethylidene]-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid
29307-60-6
Genipin 1-β-D-gentiobioside (Genipin 1-gentiobioside) is one of the most abundant and bioactive iridoid glycosides in Gardenia jasminoides Ellis, which possesses hepatoprotective, anti-inflammatory, antioxidant, and antithrombotic activities. Genipin 1-β-D-gentiobioside (Genipin 1-gentiobioside) is one of the most abundant and bioactive iridoid glycosides in Gardenia jasminoides Ellis, which possesses hepatoprotective, anti-inflammatory, antioxidant, and antithrombotic activities.
hydrangenol 4-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside
A member of the class of dihydroisocoumarins that is hydrangenol attached to a beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranosyl residue at position 4 via a glycosidic linkage. It has been isolated from the roots of Scorzonera judaica.
3,15-di-O-propionylbruceolide
A quassinoid that is the 3,15-di-O-propionyl derivative of bruceolide. It has been isolated from Brucea javanica and Brucea sumatrana.
2-[(3R,6aR,8R,10aR)-3-hydroxy-1-(3-methylphenyl)sulfonyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
2-[(3R,6aS,8S,10aS)-3-hydroxy-1-(3-methylphenyl)sulfonyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
2-[(3S,6aS,8S,10aS)-3-hydroxy-1-(3-methylphenyl)sulfonyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
2-[(3S,6aS,8R,10aS)-3-hydroxy-1-(3-methylphenyl)sulfonyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
2-[(3R,6aR,8S,10aR)-3-hydroxy-1-(3-methylphenyl)sulfonyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
1-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2R,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2S,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-propan-2-ylurea
1-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-[(2S,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
N-[(2R,3R)-2-[[[(4-fluoroanilino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2-pyrazinecarboxamide
N-[(2S,3S)-2-[[[(4-fluoroanilino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2-pyrazinecarboxamide
2-[(3S,6aR,8S,10aR)-3-hydroxy-1-(3-methylphenyl)sulfonyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
1-[(2R,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-[(2R,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-[(2R,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-[(2S,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-[(2S,3S)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
1-[(2S,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-propan-2-ylurea
N-[(2S,3R)-2-[[[(4-fluoroanilino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2-pyrazinecarboxamide
2-[(3S,6aR,8R,10aR)-3-hydroxy-1-(3-methylphenyl)sulfonyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
2-[(3R,6aS,8R,10aS)-3-hydroxy-1-(3-methylphenyl)sulfonyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
prop-2-yn-1-yl 2-acetamido-6-O-(5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl)-2-deoxy-alpha-D-galactopyranoside
3,4,5-Trihydroxy-6-[5-hydroxy-3-methoxy-2-(3-methylbut-2-enyl)-4-[2-oxo-2-(2,4,5-trihydroxyphenyl)ethyl]phenoxy]oxane-2-carboxylic acid
6-[(10-Butanoyl-3-hydroxy-2,2-dimethyl-8-oxo-6-propyl-3,4-dihydropyrano[3,2-g]chromen-5-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
(2S)-2-[[(2S)-2-[(1-ethoxycarbonylpiperidin-4-yl)oxycarbonylamino]-4-methylpentanoyl]amino]-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid
4-Hydroxyacetophenone 4-[4-hydroxybenzoyl-(->5)-apiosyl-(1->2)-glucoside]
Pluripotin
Pluripotin is a dual inhibitor of ERK1 and RasGAP with KDs of 98 nM and 212 nM, respectively. Pluripotin also inhibits RSK1, RSK2, RSK3, and RSK4 with IC50s of 0.5, 2.5, 3.3, and 10.0 μM, respectively.
SOS1-IN-14
SOS1-IN-14 is a potent, selective and orally active SOS1 inhibitor with an IC50 value of 3.9 nM. SOS1-IN-14 can be absorbed in the intestine via a P-glycoprotein-mediated efflux mechanism. SOS1-IN-14 can be used to research KRAS-mutated cancers. SOS1-IN-14 has better potent tumor suppression than BI-3406 (HY-125817)[1].
methyl (1s,4'r,4as,7s,7as)-3'-hydroxy-4'-[(4-hydroxyphenyl)methyl]-5'-oxo-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4a,7a-dihydro-1h-spiro[cyclopenta[c]pyran-7,2'-oxolane]-4-carboxylate
methyl (1s,4as,5r,7as)-5-hydroxy-7-(hydroxymethyl)-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}-1h,4ah,5h,7ah-cyclopenta[c]pyran-4-carboxylate
6-{[3,5-dihydroxy-9-(2-phenylethenyl)-6-(3-phenylprop-2-enoyl)-8,10-dioxatricyclo[7.3.1.0²,⁷]trideca-2,4,6-trien-11-yl]methyl}-5,6-dihydropyran-2-one
(2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-{4-[(2s,3r)-3-(hydroxymethyl)-5-[(1e)-3-hydroxyprop-1-en-1-yl]-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2,6-dimethoxyphenoxy}oxane-3,4,5-triol
(2s,3r,4s,5s,6r)-2-{4-[(1r,3as,4r,6as)-4-(4-hydroxy-3-methoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2,6-dimethoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
methyl (1s,4as,5r,7as)-7-(hydroxymethyl)-5-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,7ah-cyclopenta[c]pyran-4-carboxylate
methyl 5-(acetyloxy)-4-{[2,3-bis(acetyloxy)-2-methylbutanoyl]oxy}-10-methyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-6-carboxylate
1-[2-({3,4-dihydroxy-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-4,6-dihydroxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one
7-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-5-hydroxy-2-phenyl-2,3-dihydro-1-benzopyran-4-one
4-{5-hydroxy-2,2-dimethyl-8-oxo-10-phenylpyrano[2,3-h]chromen-6-yl}-2-methyl-4-oxobutyl 3-phenylprop-2-enoate
(3r,4r)-4-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}-3-[(4-hydroxy-3-methoxyphenyl)methyl]-4-methyloxolan-2-one
(3r)-3-(4-{[(2s,3r,4s,5s,6r)-6-({[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}phenyl)-8-hydroxy-3,4-dihydro-2-benzopyran-1-one
2-{4-[4-(4-hydroxy-3,5-dimethoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]-2-methoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(2s,3s,4r,5r)-2-{[(2r,3r,4r,5s,6r)-5-(benzoyloxy)-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-2,5-bis(hydroxymethyl)oxolan-3-yl benzoate
(2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-{4-[(2s,3r)-3-(hydroxymethyl)-5-[(1e)-3-hydroxyprop-1-en-1-yl]-4-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2,6-dimethoxyphenoxy}oxane-3,4,5-triol
(2s)-4-{5-hydroxy-8,8-dimethyl-2-oxo-4-phenylpyrano[2,3-f]chromen-6-yl}-2-methyl-4-oxobutyl (2e)-3-phenylprop-2-enoate
(4s,5e,6s)-4-(2-methoxy-2-oxoethyl)-5-(2-{[(2e)-3-phenylprop-2-enoyl]oxy}ethylidene)-6-{[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylic acid
methyl (4r,5r,6s)-6-(2-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}ethyl)-5-ethenyl-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-1-ene-1-carboxylate
3-(4-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}phenyl)-8-hydroxy-3,4-dihydro-2-benzopyran-1-one
2-{[5-(benzoyloxy)-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-2,5-bis(hydroxymethyl)oxolan-3-yl benzoate
(2s)-pinocembrin7-o-[β-d-apiosyl(1→2)]-β-d-glucoside
{"Ingredient_id": "HBIN006821","Ingredient_name": "(2s)-pinocembrin7-o-[\u03b2-d-apiosyl(1\u21922)]-\u03b2-d-glucoside","Alias": "NA","Ingredient_formula": "C26H30O13","Ingredient_Smile": "C1C(OC2=CC(=CC(=C2C1=O)O)OC3C(C(C(C(O3)CO)O)O)OC4C(C(CO4)(CO)O)O)C5=CC=CC=C5","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "17391","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6-o-e-p-coumaroyl scandoside methyl ester
{"Ingredient_id": "HBIN012673","Ingredient_name": "6-o-e-p-coumaroyl scandoside methyl ester","Alias": "NA","Ingredient_formula": "C26H30O13","Ingredient_Smile": "COC(=O)C1=COC(C2C1C(C=C2CO)OC(=O)C=CC3=CC=C(C=C3)O)OC4C(C(C(C(O4)CO)O)O)O","Ingredient_weight": "550.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14785","TCMID_id": "4185","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "44584784","DrugBank_id": "NA"}
6-o-z-p-coumaroyl scandoside methyl ester
{"Ingredient_id": "HBIN012743","Ingredient_name": "6-o-z-p-coumaroyl scandoside methyl ester","Alias": "NA","Ingredient_formula": "C26H30O13","Ingredient_Smile": "COC(=O)C1=COC(C2C1C(C=C2CO)OC(=O)C=CC3=CC=C(C=C3)O)OC4C(C(C(C(O4)CO)O)O)O","Ingredient_weight": "550.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14786","TCMID_id": "4186","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "44584783","DrugBank_id": "NA"}
angustiamarin
{"Ingredient_id": "HBIN016132","Ingredient_name": "angustiamarin","Alias": "NA","Ingredient_formula": "C26H30O13","Ingredient_Smile": "COC1=C(C=CC(=C1)C=CC(=O)OC2C(OC(C(C2O)O)OC3C(C4(CCOC(=O)C4=CO3)O)C=C)CO)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1243","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}