Exact Mass: 450.2339
Exact Mass Matches: 450.2339
Found 322 metabolites which its exact mass value is equals to given mass value 450.2339
,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Nigakilactone E
Cortisol lactate
Remogliflozin A
Azadiradione
Azadiradione is a tetracyclic triterpenoid that is 4,4,8-trimethylandrosta-1,14-diene substituted by oxo groups at positions 3 and 16, an acetoxy group at position 7 and a furan-3-yl group at position 17. Isolated from Azadirachta indica, it exhibits antimycobacterial and anti-inflammatory activities. It has a role as a plant metabolite, an antimycobacterial drug and an anti-inflammatory agent. It is a limonoid, a tetracyclic triterpenoid, an acetate ester, a cyclic terpene ketone and a member of furans. Azadiradione is a natural product found in Azadirachta indica, Cedrela odorata, and other organisms with data available. A tetracyclic triterpenoid that is 4,4,8-trimethylandrosta-1,14-diene substituted by oxo groups at positions 3 and 16, an acetoxy group at position 7 and a furan-3-yl group at position 17. Isolated from Azadirachta indica, it exhibits antimycobacterial and anti-inflammatory activities.
3-Acetoxy-1,3,4,4a,5,6,6a,12,12a,12b-decahydro-4,4,6a,12b-tetramethyl-9-phenyl-2H,11H-naphtho[2,1-b]pyrano[3,4-e]pyran-11-one
7beta,10beta-diacetoxy-2alpha,5alpha,13alpha-trihydroxy-2(3->20)-abeo-taxa-4(20),11-dien-9-one
(1R,4aR,5S,6R,8S,8aR)-8a-[(acetyloxy)methyl]-5-[(2S)-2-(acetyloxy)-2-(2,5-dihydro-5-oxofuran-3-yl)ethyl]-5,6-dimethylspiro[naphthalen-1(2H),2-oxiran]-8-ol|ajugadecumbenin A
16,18-Di-Ac-7,8,16,18-Tetrahydroxy-19-serrulatanoic acid
8-benzoyl-2,2-dimethyl-6-([E]-3,7-dimethyl-2,6-octadienyl)-3,5,7-trihydroxychromane|otogirinin G
(1(10)E,4Z)-8beta-(angeloyloxy)-9alpha,13-diethoxy-6alpha,15-dihydroxy-14-oxogermacra-1(10),4-dien-12-oic acid 12,6-lactone|(2Z)-2-methylbut-2-enoic acid (3S,3aS,4S,5S,6E,10Z,11aR)-5-ethoxy-3-(ethoxymethyl)-6-formyl-2,3,3a,4,5,8,9,11a-octahydro-10-(hydroxymethyl)-2-oxocyclodeca[b]furan-4-yl ester
3beta,7beta,15beta-trihydroxy-1alpha,11beta-diacetoxy-ent-kaur-16-en-6-one|nervonin E
(20S,22R)-27-hydroxy-1,4-dioxo-witha-2,5,16,24-tetraenolide
3beta,19-diacetoxy-1alpha,6beta-dihydroxy-7,16-dioxo-ent-abieta-15(17)-ene|3beta-acetoxyeriocasin D
2-deangeloylarchangelolide|8alpha-(2-Methyl)butyryloxy-10beta,11alpha-diacetoxyslov-3-enolide
(1alpha,11beta,15beta)-1,6-diacetyloxy-11,15-dihydroxy-6,7-seco-ent-kaur-16-en-7,20-olide|isorubesin B
withahisolide D|[(20S,22R,24S,25S,26R)-22,26:24,25-diepoxy-7alpha,26-dihydroxy-17(13?18)-abeo-ergost-2,5,13,15,17-pentaen-1-one]
methyl 3,5-bis(3-methyl-2-butenyl)-4-O-(beta?D-glucopyranosyl)benzoate|methyl 4-O-beta-D-glucopyranosylnervogenate
1alpha,6alpha,7beta-triacetoxy-5alpha-hydroxy-12-oxocassa-13(14)-diene|caesalpin I
6beta-hydroxy-16alpha-ethoxymethyl-19-acetoxy-6,7-seco-6,20-epoxy-1a,7-olide-ent-kaurane-15-one|sculponeatin G
2alpha,10beta-diacetoxy-13alpha,20-epoxy-3alpha,11alpha;4alpha,12alpha-dicyclotaxane-5alpha,9alpha,13beta-triol|taxpropellane
21alpha-hydroxy-20,22-dioxo-30(20-->21)abeo-21-desoxotingenone
1beta,7beta,13alpha-trihydroxy-6beta,15beta-diacetoxy-7alpha,20-epoxy-ent-kaur-16-ene|maoyecrystal L
(1S*,2S*,5Z,7S*,8R*,9S*,10S*,11R*,12R*,17R*)-2,9-diacetoxy-8,12-dihydroxybriara-5,13-dien-18-one|cavernulin B
6,17-Di-Ac-(ent-1alpha,6alpha,15alpha,16alpha)-7,20-Epoxy-1,6,7,15,16,17-Kauranehexol|Maoyerabdosin
ent-7beta,20-epoxy-1alpha,3alpha,6alpha,7alpha,15alpha-pentahydroxykaur-16-ene 6,15-diacetate (rabdolongin A)|Rabdolongin A
trans-2,3-bis(3,4,5-trimethoxybenzyl)-1,4-butanediol
(3E,7E)-2alpha,10beta-diacetoxy-5alpha,13alpha,20-trihydroxy-3,8-secotaxa-3,7,11-trien-9-one
(1S,4S,5S,6R,7S,8S,9R,10S)-1,4-dihydroxy-6-isobutyroyloxy-8-tigloyloxyeudesman-9,12-olide|wedelolide A
durumolide G|rel-(1R,3S,4S,13R,14R,7E,11E)-3,18-diacetoxy-4,13-dihydroxycembra-7,11,15(17)-trien-16,14-olide
8-Benzoyl-2-methyl-6-(3-methyl-2-butenyl)-2-(4-methyl-3-pentenyl)3,4-dihydro-2H-1-benzopyran-3,5,7-triol
(3E,7E)-10beta,13alpha-diacetoxy-2alpha,5alpha,20-trihydroxy-3,8-secotaxa-3,7,11-trien-9-one
michaolide K
A cembrane diterpenoid with cytotoxic activity isolated from the soft coral Lobophytum michaelae.
(12S)-6alpha,19-diacetoxy-12-hydroxy-4,18-epoxyneoclerod-13(14)-en-15,16-olide|6,19-diacetylteumassilin|ajugalide C|ajugalide-C
C28H34O5_17-(3-Furyl)-4,4,8-trimethyl-3,16-dioxoandrosta-1,14-dien-7-yl acetate
[(7R,8R,10R,13S)-17-(furan-3-yl)-4,4,8,10,13-pentamethyl-3,16-dioxo-6,7,9,11,12,17-hexahydro-5H-cyclopenta[a]phenanthren-7-yl] acetate
4,4-Tricyclo[3.3.1.13,7]decane-2,2-diyldiphenol - 2,2-[oxybis(methylene)]dioxirane (1:1)
17-Epiazadiradione
A limonoid that is the C-17 epimer of azadiradione. It has been isolated from Azadirachta indica.
N-cyclopentyl-2-imino-1-[3-(4-morpholinyl)propyl]-5-oxo-3-dipyrido[1,2-d:3,4-f]pyrimidinecarboxamide
2-[4,10-bis(carboxymethyl)-7-[(2S,3R)-1,3,4-trihydroxybutan-2-yl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
2-(2,5-dimethoxyanilino)-N-[3-(4-morpholinyl)propyl]-4-quinolinecarboxamide
N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-pyrazinecarboxamide
N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-pyrazinecarboxamide
(2R,3R,3aS,9bS)-2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-(hydroxymethyl)-6-oxo-N-propan-2-yl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-1-carboxamide
(1R,9S,10S,11S)-N-(cyclohexylmethyl)-10-(hydroxymethyl)-6-oxo-12-(pyridine-3-carbonyl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
(2R,3R,3aS,9bS)-N-(cyclopropylmethyl)-7-[3-[dimethylamino(oxo)methyl]phenyl]-3-(hydroxymethyl)-6-oxo-1,2,3,3a,4,9b-hexahydropyrrolo[2,3-a]indolizine-2-carboxamide
N-[(2R,3S,6S)-6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]pyrazine-2-carboxamide
N-[(2R,3R,6S)-6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]pyrazine-2-carboxamide
N-[(2S,3S,6S)-6-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]pyrazine-2-carboxamide
(1R,9S,10S,11S)-12-benzoyl-10-(hydroxymethyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
(2S,3S,3aR,9bR)-2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-3-(hydroxymethyl)-6-oxo-N-propan-2-yl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-1-carboxamide
(1S,9R,10R,11R)-N-(cyclohexylmethyl)-10-(hydroxymethyl)-6-oxo-12-(pyridine-3-carbonyl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-pyrazinecarboxamide
N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-pyrazinecarboxamide
(1S,9R,10R,11R)-N-cyclobutyl-5-[3-(dimethylcarbamoyl)phenyl]-10-(hydroxymethyl)-6-oxo-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
(1S,9R,10R,11R)-12-benzoyl-10-(hydroxymethyl)-6-oxo-N-(2-pyrrolidin-1-ylethyl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-pyrazinecarboxamide
(1R,9S,10S,11S)-N-cyclobutyl-5-[3-(dimethylcarbamoyl)phenyl]-10-(hydroxymethyl)-6-oxo-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
(2S,3S,3aR,9bR)-N-(cyclopropylmethyl)-7-[3-[dimethylamino(oxo)methyl]phenyl]-3-(hydroxymethyl)-6-oxo-1,2,3,3a,4,9b-hexahydropyrrolo[2,3-a]indolizine-2-carboxamide
2-[(3R,6aR,8R,10aR)-1-(cyclopentylmethyl)-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide
2-[(3R,6aR,8S,10aR)-1-(cyclopentylmethyl)-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide
(1-butanoyloxy-3-phosphonooxypropan-2-yl) (Z)-tetradec-9-enoate
(1-phosphonooxy-3-propanoyloxypropan-2-yl) (Z)-pentadec-9-enoate
(1-acetyloxy-3-phosphonooxypropan-2-yl) (Z)-hexadec-9-enoate
(1-pentanoyloxy-3-phosphonooxypropan-2-yl) (Z)-tridec-9-enoate
3,6-dihydroxy-2,6-dimethyl-10-methylidene-8-[(2-methylpropanoyl)oxy]-11-oxo-12-oxatricyclo[7.3.1.0²,⁷]tridecan-13-yl 2-methylbut-2-enoate
3,9-dihydroxy-4,6b,8a,11,12b,14a-hexamethyl-9,11,12,12a,13,14-hexahydro-8h-picene-2,7,10-trione
[2-(acetyloxy)-5-[2-(furan-3-yl)ethyl]-5,8-dihydroxy-1,4a,6-trimethyl-7-oxo-hexahydronaphthalen-1-yl]methyl acetate
(1s,3s,4ar,6as,7s,10ar,11as,11br)-3-(acetyloxy)-6a,7-dihydroxy-4,4,8,11b-tetramethyl-9-oxo-1h,2h,3h,4ah,5h,6h,7h,10ah,11h,11ah-phenanthro[3,2-b]furan-1-yl acetate
14-hydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-3,11-dioxo-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadec-4-en-16-yl acetate
(1r,4ar,5s,6s,7r,8r,8as)-8-(acetyloxy)-5-[2-(furan-3-yl)-2-hydroxyethyl]-7-hydroxy-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8a-ylmethyl acetate
(1r,2r,3r,4r,6s,8s,9r,10s,11s,13s)-6-(acetyloxy)-2,8,11-trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-3-yl acetate
10-hydroxy-6,10-dimethyl-3-methylidene-11-[(2-methylpropanoyl)oxy]-2,5-dioxo-octahydrocyclodeca[b]furan-4-yl 2-methylbut-2-enoate
(4ar,5as,6ar,12ar,12br)-9-[(1s)-1-[(1s,2r,4s,6s)-2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl]ethyl]-12b-methyl-4h,5ah,6h,6ah,11h,12h,12ah-chryseno[6,6a-b]oxiren-1-one
(4ar,5as,6ar,12as,12br)-9-[(1s)-1-[(1s,2r,4r,6s)-2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl]ethyl]-12b-methyl-4h,5ah,6h,6ah,11h,12h,12ah-chryseno[6,6a-b]oxiren-1-one
15-(acetyloxy)-7,9,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-10-yl acetate
10-(acetyloxy)-9,13,15-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-yl acetate
(1r,2r,3r,4r,6s,8s,9s,10s,11s,13s)-6-(acetyloxy)-3,8,11-trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-2-yl acetate
(3s,4ar,6as,12br,14as,14bs)-3,10-dihydroxy-3,4a,6a,9,12b,14a-hexamethyl-1,5,6,13,14,14b-hexahydropicene-2,4,11-trione
(1s,2r,3r,4r,7s,8z,12r,13s,14s)-14-(acetyloxy)-2,3-dihydroxy-4,9,13,17-tetramethyl-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadeca-8,16-dien-12-yl acetate
(1s,2s,3r,4r,7s,8z,12s,13s,14s)-14-(acetyloxy)-2,3-dihydroxy-4,9,13-trimethyl-17-methylidene-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadec-8-en-12-yl acetate
[(1s,2r,4ar,5s,6r,8s,8ar)-2-(acetyloxy)-5-[2-(furan-3-yl)ethyl]-5,8-dihydroxy-1,4a,6-trimethyl-7-oxo-hexahydronaphthalen-1-yl]methyl acetate
7-(acetyloxy)-3,6,11-trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-2-yl acetate
(1r,3as,3bs,9ar,9bs,11as)-9a,11a-dimethyl-1-[(1r,4r,5r)-1-methyl-8-methylidene-7-oxo-2,6-dioxabicyclo[3.3.1]nonan-4-yl]-1h,2h,3h,3ah,3bh,4h,6h,9bh,10h-cyclopenta[a]phenanthrene-9,11-dione
6-(acetyloxy)-2,8,11-trihydroxy-5,5,9-trimethyl-14-methylidene-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-3-yl acetate
2α,7β-diacetoxy-5α,10β,13α-trihydroxy-2(3→20)abeotaxane-9-one
{"Ingredient_id": "HBIN005253","Ingredient_name": "2\u03b1,7\u03b2-diacetoxy-5\u03b1,10\u03b2,13\u03b1-trihydroxy-2(3\u219220)abeotaxane-9-one","Alias": "NA","Ingredient_formula": "C24H34O8","Ingredient_Smile": "CC1=C2C(C(=O)C3(CC(=CC(C(C2(C)C)CC1OC(=O)C)O)C(CC3OC(=O)C)O)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5319","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3 e,7 e)-2α,10β-diacetoxy-5α,13α,20-trihydroxy-3,8-secotaxa-3,7,11-trien-9-one
{"Ingredient_id": "HBIN008456","Ingredient_name": "(3 e,7 e)-2\u03b1,10\u03b2-diacetoxy-5\u03b1,13\u03b1,20-trihydroxy-3,8-secotaxa-3,7,11-trien-9-one","Alias": "(3e,7e)-2alpha,10beta-diacetoxy-5alpha,13alpha,20-trihydroxy-3,8-secotaxa-3,7,11-trien-9-one","Ingredient_formula": "C24H34O8","Ingredient_Smile": "CC1=CCC(C(=CC(C2CC(C(=C(C2(C)C)C(C1=O)OC(=O)C)C)OC(=O)C)O)CO)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5322;30885","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7β,13α-diacetoxy-2α,5α,10β-trihydroxy-2(3→20)abeotaxane-9-one
{"Ingredient_id": "HBIN013063","Ingredient_name": "7\u03b2,13\u03b1-diacetoxy-2\u03b1,5\u03b1,10\u03b2-trihydroxy-2(3\u219220)abeotaxane-9-one","Alias": "NA","Ingredient_formula": "C24H34O8","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5320","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7β,9α-diacetoxy-5α,13α,14β-trihydroxy-10-oxo-taxa-4(20),11-diene
{"Ingredient_id": "HBIN013093","Ingredient_name": "7\u03b2,9\u03b1-diacetoxy-5\u03b1,13\u03b1,14\u03b2-trihydroxy-10-oxo-taxa-4(20),11-diene","Alias": "7beta,9alpha-diacetoxy-5alpha,13alpha,14beta-trihydroxy-10-oxotaxa-4(20),11-diene","Ingredient_formula": "C24H34O8","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5321;30884","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
adenanthin i
{"Ingredient_id": "HBIN014680","Ingredient_name": "adenanthin i","Alias": "NA","Ingredient_formula": "C24H34O8","Ingredient_Smile": "CC(=O)OC1CC(C2(C3C(CC4CC3(C(C(C2C1(C)C)O)OC(=O)C)C(=O)C4=C)O)C)O","Ingredient_weight": "450.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "613","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11091621","DrugBank_id": "NA"}