Exact Mass: 470.2727
Exact Mass Matches: 470.2727
Found 314 metabolites which its exact mass value is equals to given mass value 470.2727
,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Withaferin_A
Withaferin A is a withanolide that is 5,6:22,26-diepoxyergosta-2,24-diene-1,26-dione substituted by hydroxy groups at positions 4 and 27 (the 4beta,5beta,6beta,22R stereoisomer). Isolated from Physalis longifolia, it exhibits cytotoxic activity. It has a role as an antineoplastic agent and an apoptosis inducer. It is a delta-lactone, a 4-hydroxy steroid, an enone, an ergostanoid, a secondary alcohol, a withanolide, a 27-hydroxy steroid, a primary alcohol and an epoxy steroid. Ashwagandha is a popular Ayurvedic herb used as a general tonic, to increase energy and reduce stress. Ashwagandha has not been implicated in causing serum enzyme elevations during therapy, but recently has been implicated in rare cases of clinically apparent liver injury. Withaferin A is a natural product found in Vassobia breviflora, Withania somnifera, and other organisms with data available. A withanolide that is 5,6:22,26-diepoxyergosta-2,24-diene-1,26-dione substituted by hydroxy groups at positions 4 and 27 (the 4beta,5beta,6beta,22R stereoisomer). Isolated from Physalis longifolia, it exhibits cytotoxic activity. Withaferin A is a steroidal lactone isolated from Withania somnifera, inhibits NF-kB activation and targets vimentin, with potent antiinflammatory and anticancer activities. Withaferin A is an inhibitor of endothelial protein C receptor (EPCR) shedding. Withaferin A is a steroidal lactone isolated from Withania somnifera, inhibits NF-kB activation and targets vimentin, with potent antiinflammatory and anticancer activities. Withaferin A is an inhibitor of endothelial protein C receptor (EPCR) shedding.
Withanolide
Withanolides, which are extracted from Withania somnifera, are employed in the treatment of arthritis and are known to be potent inhibitors of angiogenesis, inflammation and oxidative stress. Withanolides can indeed inhibit the activation of NF-κB and NF-κB-regulated gene expression, which could explain their anti-arthritic actions. W. somnifera root powder has suppressive effect on arthritis by reducing amplification and propagation of the inflammatory response, without causing any gastric damage. (PMID: 17475558, 3248848, 17084827).
Withanolide A
Withanolide A is found in herbs and spices. Withanolide A is isolated from Lycium chinense (Chinese boxthorn Isolated from Lycium chinense (Chinese boxthorn). Withanolide A is found in tea and herbs and spices.
Methyl lucidenate F
Methyl lucidenate F is found in mushrooms. Methyl lucidenate F is a constituent of Ganoderma lucidum (reishi).
Desisobutyrylciclesonide
Withaferin A
CID 92044470
Ingenol-5,20-acetonide-3-O-angelate is a natural compound.
5,7alpha-epoxy-6alpha,20alpha-dihydroxy-1-oxowitha-2,24-dienolide
(4beta,17alphaOH,22R)-4,17,27-Trihydroxy1-oxowitha-2,5,24-trienolide
5alpha,14alpha,20alphaF(R)-trihydroxy-1-oxowitha-2,7,24-trienolide|withasomniferol C
(17R,20S,22R)-5beta,6beta-epoxy-4beta,18-dihydroxy-1-oxowitha-2,24-dienolide|18-deacetylwithacnistine
4-Phenylphenacyl ester-(E)-11,17-Octadecadien-9-ynoic acid
(17R)-14,17,20-trihydroxy-22,26-epoxyergosta-2,5,24-triene-1,26-dione|Withanolide J
(17R,20S,22R)-5beta,6beta-epoxy-4beta,16alpha-dihydroxy-1-oxowitha-2,24-dienolide|16-deacetyliochromolide
Baimantuoluoside C
12-deoxywithastramonolide is a withanolide. 12-Deoxywithastramonolide is a natural product found in Withania somnifera and Datura metel with data available. 12-Deoxywithastramonolide is a principle bioactive compound found in ashwagandha (W. somnifera). 12-Deoxywithastramonolide possesses antioxidant and enzyme inhibitory effects[1]. 12-Deoxywithastramonolide is a principle bioactive compound found in ashwagandha (W. somnifera). 12-Deoxywithastramonolide possesses antioxidant and enzyme inhibitory effects[1].
2beta-(angeloyloxy)-6alpha-(p-anisoyloxy)-4beta-hydroxydauc-8-ene|tunetanin A
(20R,22R)-14alpha,17alpha,19-trihydroxy-1-oxowitha-2,5,24-trien-22,26-olide|cinerolide
6alpha,7alpha-epoxy-5alpha-hydroxy-17alpha-[(1R,4R,5R,7R)-4-hydroxy-4,5-dimethyl-3-oxo-2-oxabicyclo[3.2.1]octan-7-yl]androst-2-en-1-one|mandragorolide A
2-(1-oxo-2-hydroxyethyl)-3-hydroxy-5-(3-methyl-2-butenyloxy)-6-(3-methyl-2-butenyl)-6(S)-(3,7-dimethyl-8-oxo-2E,6E-octadienyl)-2,4-cyclohexadien-1-one|coodeanone C
(14S,17R,20S,22R)-14,17,20,22-tetrahydroxy-1-oxoergosta-3,5,24-trien-26-oic acid 22,26-lactone|withacoagulin I
(20R,22R)-14,20alpha,27-trihydroxy-1-oxowitha-3,5,24-trienolide|1-oxo-14,20alphaF,27-trihydroxy-20R,22R-witha-3,5,24-trienolide|14alpha,20alphaF,27-trihydroxy-1-oxo-(22R)-witha-3,5,24-trienolide
Withanolide A
Withanolide A is a withanolide. withanolide A is a natural product found in Withania somnifera, Withania coagulans, and Discopodium penninervium with data available.
3beta,17beta-dihydroxy-14,20-epoxy-1-oxo-(22R)-witha-5,24-dienolide|3beta,17beta-dihydroxy-14,20-epoxy-1-oxo-22R-witha-5,24-dienolide|ajugin|coagulin R
17-hydroxy,27-deoxy-withaferin A|17-hydroxy-27-deoxy withaferin A|17-hydroxy-27-deoxywithaferin A|27-deoxy-17-hydroxywithaferin A
3beta,17beta,20-Trihydroxy-1-oxo-(20R,22R)-witha-5,14,24-trienolide
3-(4-O-acetyl-6-deoxy-beta-galactopyranosyloxy)-19-norpregna-1,3,5(10),20-tetrae-ne
4-desmethoxy-16-dehydrowithangulatin E|withangulatin F
Withanone
Annotation level-1 Withanone is a natural product found in Withania somnifera, Physalis philadelphica, and Discopodium penninervium with data available.
Withaferin A
Withaferin A is a steroidal lactone isolated from Withania somnifera, inhibits NF-kB activation and targets vimentin, with potent antiinflammatory and anticancer activities. Withaferin A is an inhibitor of endothelial protein C receptor (EPCR) shedding. Withaferin A is a steroidal lactone isolated from Withania somnifera, inhibits NF-kB activation and targets vimentin, with potent antiinflammatory and anticancer activities. Withaferin A is an inhibitor of endothelial protein C receptor (EPCR) shedding.
Glu Ile Ile Pro
Glu Ile Leu Pro
Glu Ile Pro Ile
Glu Ile Pro Leu
Glu Leu Ile Pro
Glu Leu Leu Pro
Glu Leu Pro Ile
Glu Leu Pro Leu
Glu Pro Ile Ile
Glu Pro Ile Leu
Glu Pro Leu Ile
Glu Pro Leu Leu
Ile Glu Ile Pro
Ile Glu Leu Pro
Ile Glu Pro Ile
Ile Glu Pro Leu
Ile Ile Glu Pro
Ile Ile Pro Glu
Ile Leu Glu Pro
Ile Leu Pro Glu
Ile Pro Glu Ile
Ile Pro Glu Leu
Ile Pro Ile Glu
Ile Pro Leu Glu
Leu Glu Ile Pro
Leu Glu Leu Pro
Leu Glu Pro Ile
Leu Glu Pro Leu
Leu Ile Glu Pro
Leu Ile Pro Glu
Leu Leu Glu Pro
Leu Leu Pro Glu
Leu Pro Glu Ile
Leu Pro Glu Leu
Leu Pro Ile Glu
Leu Pro Leu Glu
Pro Glu Ile Ile
Pro Glu Ile Leu
Pro Glu Leu Ile
Pro Glu Leu Leu
Pro Ile Glu Ile
Pro Ile Glu Leu
Pro Ile Ile Glu
Pro Ile Leu Glu
Pro Leu Glu Ile
Pro Leu Glu Leu
Pro Leu Ile Glu
Pro Leu Leu Glu
Methyl lucidenate F
Withanolide
A withanolide that is 5,6:22,26-diepoxyergosta-2,24-diene-1,26-dione substituted by hydroxy groups at positions 4 and 22 (the 4beta,5beta,6beta,22R stereoisomer). Isolated from Tubocapsicum anomalum and Withania somnifera, it exhibits cytotoxic activity. Withanolides, which are extracted from Withania somnifera, are employed in the treatment of arthritis and are known to be potent inhibitors of angiogenesis, inflammation and oxidative stress. Withanolides can indeed inhibit the activation of NF-κB and NF-κB-regulated gene expression, which could explain their anti-arthritic actions. W. somnifera root powder has suppressive effect on arthritis by reducing amplification and propagation of the inflammatory response, without causing any gastric damage. (PMID: 17475558, 3248848, 17084827) [HMDB]
Withanolide
Withalongolide B
A withanolide that is 27-deoxywithaferin A substituted by a hydroxy group at position 19. Isolated from Physalis longifolia, it exhibits antineoplastic activity.
bis(2-methacryloxyethyl)-n,n-1,9-nonylene biscarbamate
Methyl [(2S)-3-methyl-1-oxo-1-{(2S)-2-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzimidazol-2-yl]-1-pyrrolidinyl}-2-butanyl]carbamate
TERT-BUTYL 3,5-BIS(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRROLO[2,3-B]PYRIDINE-1-CARBOXYLATE
Methanone, ((3S,4R)-4-(2,4-difluorophenyl)-1-(1,1-dimethylethyl)-3-pyrrolidinyl)((3R,5S)-4-hydroxy-3,5-dimethyl-4-phenyl-1-piperidinyl)-
Bacilysocin
A carboxylic ester resulting from the formal condensation of the carboxylic acid group of 12-methyltetradecanoic acide with one of the primary alcoholic hydroxy groups of glycerophosphoglycerol. An antibiotic obtained from Bacillus subtilis 168, it has particular activity against certain fungi. The stereochemistries of the hydroxy groups at positions C-2 and C-2 and the methyl group at position C-12 have not been determined.
[1-(Furan-3-yl)-8-hydroxy-4b,7,7,10a,12a-pentamethyl-3-oxo-1,5,6,6a,8,9,10,10b,11,12-decahydronaphtho[2,1-f]isochromen-5-yl] acetate
(1S,2S,4S,5R,10R,14S,15S,18S)-15-[(1R)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-1-hydroxyethyl]-5-hydroxy-10,14-dimethyl-3-oxapentacyclo[9.7.0.02,4.05,10.014,18]octadec-7-en-9-one
Tubocapsanolide F
A withanolide that is 5,6:22,26-diepoxyergosta-2,24-diene-1,26-dione substituted by hydroxy groups at positions 4 and 17 (the 4beta,5beta,6beta,22R stereoisomer). Isolated from Tubocapsicum anomalum, it exhibits cytotoxic activity.
(3aS,5aR,9bR)-5a,9-dimethyl-3-methylene-4,5,6,7,8,9b-hexahydro-3aH-benzo[g]benzofuran-2-one
(2S,6S,7S,9R,11R,12R,15R,16R)-6-hydroxy-15-[1-[(2S)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-3-one
(2S,6S,7S,9R,11R,15R,16R)-6-hydroxy-15-[1-[(2S)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-3-one
[3-[2,3-Dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hydroxypropyl] pentadecanoate
[(2R)-1,1,2,3,3-pentadeuterio-3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hydroxypropyl] pentadecanoate
[(2R)-1,1,3,3-tetradeuterio-3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hydroxypropyl] pentadecanoate
2-[2-[3-(1-Methylethylamino)-2-hydroxypropyloxy]ethyl]-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid 3-pyridyl ester
(1s,2s,4s,5r,10r,11s,14r,15r,18s)-5-hydroxy-15-[(1s)-1-[(2r)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-10,14-dimethyl-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadec-7-en-9-one
3-hydroxy-3-isopropyl-6,8a-dimethyl-8-[(2-methylbut-2-enoyl)oxy]-1,2,3a,4,5,8-hexahydroazulen-4-yl 4-methoxybenzoate
(1r,2r,4s,6r,7r,10s,11r,15s,16r)-15-hydroxy-6-[(1s)-1-[(2r)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-7,11-dimethyl-3-oxapentacyclo[8.8.0.0²,⁴.0²,⁷.0¹¹,¹⁶]octadec-13-en-12-one
15-[1-(4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-5,15-dihydroxy-10,14-dimethyl-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadec-7-en-9-one
15-{2-hydroxy-1-[5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl}-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one
5-hydroxy-2,16-dimethyl-15-{1-methyl-8-methylidene-7-oxo-2,6-dioxabicyclo[3.3.1]nonan-4-yl}-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadecan-3-one
(6s)-6-[(1s)-1-[(1r,3ar,3br,9ar,9bs,11as)-1,3a-dihydroxy-9a,11a-dimethyl-9-oxo-2h,3h,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-hydroxyethyl]-3,4-dimethyl-5,6-dihydropyran-2-one
(1s,2r,6s,7r,9r,11s,12s,14r,15r,16s)-15-[(1s)-1-[(2r)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-6,14-dihydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one
(1r,2r,7r,10r,11s,14r,15r,16r)-16-(4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl)-7,15-dihydroxy-10,14,16-trimethyl-17-oxapentacyclo[13.2.2.0¹,¹⁴.0²,¹¹.0⁵,¹⁰]nonadec-4-en-9-one
(2s)-2-[(2r,3r,4s)-3-[(1e,3e,5e,7e,9e)-10-[(2r,5s,6s)-5-hydroxy-3,5,6-trimethyl-2,6-dihydropyran-2-yl]undeca-1,3,5,7,9-pentaen-1-yl]-3,4-dimethyl-5-oxooxolan-2-yl]propanoic acid
3,3',4'-trihydroxy-4,5,5,10',14',16'-hexamethyl-18'-oxaspiro[oxolane-2,17'-pentacyclo[13.3.2.0¹,¹⁴.0²,¹¹.0⁵,¹⁰]icosane]-2'(11'),5',12'-trien-7'-one
6-[(1r)-1-[(1s,3as,5as,9ar,9bs,11ar)-3a,5a-dihydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-hydroxyethyl]-3,4-dimethyl-5,6-dihydropyran-2-one
(6r)-6-[(1r)-1-[(1s,3ar,3br,6s,9ar,9bs,11ar)-3a,6-dihydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,3bh,4h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-hydroxyethyl]-3,4-dimethyl-5,6-dihydropyran-2-one
(1r,3as,4r,8s,8as)-1-hydroxy-1-isopropyl-3a,6-dimethyl-8-{[(2e)-2-methylbut-2-enoyl]oxy}-2,3,4,7,8,8a-hexahydroazulen-4-yl 4-methoxybenzoate
15-hydroxy-6-{1-[5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl}-7,11-dimethyl-3-oxapentacyclo[8.8.0.0²,⁴.0²,⁷.0¹¹,¹⁶]octadec-13-en-12-one
2-{3-[10-(5-hydroxy-3,5,6-trimethyl-2,6-dihydropyran-2-yl)undeca-1,3,5,7,9-pentaen-1-yl]-3,4-dimethyl-5-oxooxolan-2-yl}propanoic acid
(1s,2r,7s,9r,11s,12s,15r,16s)-15-hydroxy-15-[(1r,4r,5r,7s)-4-hydroxy-4,5-dimethyl-3-oxo-2-oxabicyclo[3.2.1]octan-7-yl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one
(1s,2r,7r,9s,11r,14s,15s)-14-hydroxy-15-[(1s)-1-[(1s,2r,4s,6s)-2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl]ethyl]-2,15-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadeca-4,12(16)-dien-3-one
(20s,22r)-5α,27-dihydroxy-6α,7α-epoxy-1-oxo-witha-2,24-dienolide
{"Ingredient_id": "HBIN003477","Ingredient_name": "(20s,22r)-5\u03b1,27-dihydroxy-6\u03b1,7\u03b1-epoxy-1-oxo-witha-2,24-dienolide","Alias": "NA","Ingredient_formula": "C28H38O6","Ingredient_Smile": "CC1=C(C(=O)OC(C1)C(C)C2CCC3C2(C(CC4C3C5C(O5)C6(C4(C(=O)C=CC6)C)O)O)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5879","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6α,7α-epoxy-5α,20β-dihydroxy-1-oxowitha-2,24-dienolide
{"Ingredient_id": "HBIN012189","Ingredient_name": "6\u03b1,7\u03b1-epoxy-5\u03b1,20\u03b2-dihydroxy-1-oxowitha-2,24-dienolide","Alias": "NA","Ingredient_formula": "C28H38O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7081","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
ajugin
{"Ingredient_id": "HBIN014987","Ingredient_name": "ajugin","Alias": "NA","Ingredient_formula": "C28H38O6","Ingredient_Smile": "CC1=C(C(=O)OC(C1)C2(C3(CCC4(C3(CCC5C4CC=C6C5(C(=O)CC(C6)O)C)C)O2)O)C)C","Ingredient_weight": "470.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "812","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "100982555","DrugBank_id": "NA"}