Exact Mass: 450.393356
Exact Mass Matches: 450.393356
Found 172 metabolites which its exact mass value is equals to given mass value 450.393356,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Vitamin K
D006401 - Hematologic Agents > D003029 - Coagulants > D006490 - Hemostatics D050299 - Fibrin Modulating Agents > D000933 - Antifibrinolytic Agents D018977 - Micronutrients > D014815 - Vitamins Widely distributed in green leaves and vegetables, especies cabbage and spinach. Infant formula fortifier. Phytomenadione is found in many foods, some of which are swiss chard, fruit salad, milk (cow), and common buckwheat. Vitamin K1 a naturally occurring vitamin required for blood coagulation and bone and vascular metabolism. Vitamin K1 a naturally occurring vitamin required for blood coagulation and bone and vascular metabolism.
6-Deoxocastasterone
6-Deoxocastasterone belongs to the class of organic compounds known as tetrahydroxy bile acids, alcohols, and derivatives. These are prenol lipids structurally characterized by a bile acid or alcohol which bears four hydroxyl groups. Thus, 6-deoxocastasterone is considered to be a sterol lipid molecule. 6-Deoxocastasterone is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral. 6-Deoxocastasterone is found in common bean and has been isolated from Phaseolus vulgaris (kidney bean). Isolated from Phaseolus vulgaris (kidney bean). 6-Deoxocastasterone is found in many foods, some of which are jerusalem artichoke, alaska blueberry, sourdough, and yautia.
Vitamin K1
Phylloquinone is a member of the class of phylloquinones that consists of 1,4-naphthoquinone having methyl and phytyl groups at positions 2 and 3 respectively. The parent of the class of phylloquinones. It has a role as a cofactor, a plant metabolite and a human metabolite. It is a vitamin K and a member of phylloquinones. Vitamin K1, also called phylloquinone or phytonadione, is a fat soluble vitamin. Phylloquinone is a cofactor of the enzyme γ-carboxylase, which modifies and activates precursors to coagulation factors II, VII, IX, and X. It is indicated in the treatment of coagulation disorders due to faulty formation of coagulation factors II, VII, IX, and X caused by deficiency or interference in the activity of vitamin K. Phylloquinone has been synthesized since at least 1939, and was approved by the FDA prior to 1955. Vitamin K1 is a natural product found in Coffea arabica, Stachys annua, and other organisms with data available. Phytonadione is an analogue of the naphthoquinone vitamin K found in plants. The vitamins K are essential for blood coagulation as it is necessary for the hepatic synthesis of the coagulation factors II, VII, IX, and X; deficiency results in a bleeding diathesis. These vitamins are lipo-soluble; absorption via intestinal lymphatics requires the presence of bile salts. (NCI04) Phylloquinone is often called vitamin K1. It is a fat-soluble vitamin that is stable to air and moisture but decomposes in sunlight. It is found naturally in a wide variety of green plants. Phylloquinone is also an antidote for coumatetralyl. Vitamin K is needed for the posttranslational modification of certain proteins, mostly required for blood coagulation. A family of phylloquinones that contains a ring of 2-methyl-1,4-naphthoquinone and an isoprenoid side chain. Members of this group of vitamin K 1 have only one double bond on the proximal isoprene unit. Rich sources of vitamin K 1 include green plants, algae, and photosynthetic bacteria. Vitamin K1 has antihemorrhagic and prothrombogenic activity. See also: Broccoli (part of); Kale, cooked (part of); Cholecalciferol; phytonadione (component of) ... View More ... Vitamin K1, also known as phylloquinone or phytonadione, is a polycyclic aromatic ketone, based on 1,4-naphthoquinone, with 2-methyl and 3-phytyl substituents. Vitamin K is a family of phylloquinones that contain a ring of 2-methyl-1,4-naphthoquinone and an isoprenoid side chain. Several forms of vitamin K have been identified: vitamin K1 derived from plants, vitamin K2 (menaquinone) from bacteria and synthetic naphthoquinone provitamins, and vitamin K3 (menadione). Vitamin K1 has only one double bond on the proximal isoprene unit. Vitamin K1 possesses the same type and degree of activity as does naturally-occurring vitamin K, which is necessary for the production via the liver of active prothrombin (factor II), proconvertin (factor VII), plasma thromboplastin component (factor IX), and Stuart factor (factor X). Rich sources of vitamin K1 include green plants, algae, and photosynthetic bacteria. Vitamin K1 has antihemorrhagic and prothrombogenic activity. Vitamin K1 is a fat-soluble vitamin that is stable to air and moisture but decomposes in sunlight. Vitamin K1 is an antidote for coumatetralyl. A member of the class of phylloquinones that consists of 1,4-naphthoquinone having methyl and phytyl groups at positions 2 and 3 respectively. The parent of the class of phylloquinones. B - Blood and blood forming organs > B02 - Antihemorrhagics > B02B - Vitamin k and other hemostatics > B02BA - Vitamin k D006401 - Hematologic Agents > D003029 - Coagulants > D006490 - Hemostatics D050299 - Fibrin Modulating Agents > D000933 - Antifibrinolytic Agents D018977 - Micronutrients > D014815 - Vitamins Vitamin K1 a naturally occurring vitamin required for blood coagulation and bone and vascular metabolism. Vitamin K1 a naturally occurring vitamin required for blood coagulation and bone and vascular metabolism.
3-epi-6-Deoxocastasterone
3-epi-6-deoxocastasterone belongs to tetrahydroxy bile acids, alcohols and derivatives class of compounds. Those are prenol lipids structurally characterized by a bile acid or alcohol which bears four hydroxyl groups. 3-epi-6-deoxocastasterone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 3-epi-6-deoxocastasterone can be found in common bean, green bean, and yellow wax bean, which makes 3-epi-6-deoxocastasterone a potential biomarker for the consumption of these food products.
N,N-(Hexane-1,6-diyl)bis(N-(2,2,6,6-tetramethylpiperidin-4-yl)formamide)
(1R,1R,2S,2S,4aR,4aR,6R,6S,8aS,8aS)-1,1-(ethane-1,2-diyl)bis[decahydro-5,5,8a-trimethylnaphthalene-2,6-diol]|(3beta,8beta,14alpha,21beta)-26,27-dinoronocerane-3,8,14,21-tetrol
(24S)-24-methylcholestane-3beta,5alpha,6beta,7beta-tetrol|(24S)-ergostane-3beta,5alpha,6beta,7beta-tetrol|(3beta,5alpha,6beta,7beta,24S)-Ergostane-3,5,6,7-tetrol|5alpha-ergostane-3beta,5,6beta,7beta-tetrol
(24S)-24-methyl-5alpha-cholestane-1beta,3beta,5,6beta-tetrol|(24S)-24-methylcholestane-1beta,3beta,5alpha,6beta-tetrol|(24S)-ergostane-1beta,3beta,5alpha,6beta-tetraol
24beta-Ethylcholesta-5,7,9(11),22E-tetraen-3beta-ol acetate
20-(N-methylamino)-3beta-(N-methylbenzamido)-5alpha-pregnane|hookerianamide I
C30H46N2O (450.36099459999997)
Vitamin K1
relative retention time with respect to 9-anthracene Carboxylic Acid is 1.858 Vitamin K1 a naturally occurring vitamin required for blood coagulation and bone and vascular metabolism. Vitamin K1 a naturally occurring vitamin required for blood coagulation and bone and vascular metabolism.
[2,5-bis(3,7-dimethyloctoxy)-4-(hydroxymethyl)phenyl]methanol
hookerianamide I
C30H46N2O (450.36099459999997)
A steroid alkaloid that is 5alpha-pregnane substituted by a N-methylamino group at position 20 and a beta-N-methylbenzamido group at position 3. Isolated from Sarcococca hookeriana, it exhibits antiplasmodial activity and inhibitory activity against cholinesterase.
[3-carboxy-2-[(8E,11E,14E)-icosa-8,11,14-trienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(5E,8E,11E)-icosa-5,8,11-trienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(11Z,14E,17E)-icosa-11,14,17-trienoyl]oxypropyl]-trimethylazanium
2-((2E,7E)-3,7-dimethyl-9-((1S,4aS,8aS)-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)nona-2,7-dienyl)benzene-1,4-diol
A natural product found in Coscinoderma species.
[3-carboxy-2-[(5Z,8Z,11Z)-icosa-5,8,11-trienoyl]oxypropyl]-trimethylazanium
dimethyl-bis[(E)-4-[tris(2-hydroxyethyl)azaniumyl]but-2-enyl]azanium
[3-carboxy-2-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyl]oxypropyl]-trimethylazanium
[1-hydroxy-3-[(11Z,14Z,17Z)-icosa-11,14,17-trienoxy]propan-2-yl] pentanoate
(1-hydroxy-3-nonoxypropan-2-yl) (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate
[1-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoxy]-3-hydroxypropan-2-yl] nonanoate
[1-hydroxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoxy]propan-2-yl] heptanoate
[1-[(10Z,13Z,16Z)-docosa-10,13,16-trienoxy]-3-hydroxypropan-2-yl] propanoate
2-[(15Z,18Z)-hexacosa-15,18-dienoyl]oxyacetic acid
2-methyl-3-(3,7,11,15-tetramethylhexadec-2-enyl)naphthalene-1,4-dione
(4as,6s)-5-{2-[(6r)-2,6-dihydroxy-5,5,8a-trimethyl-octahydronaphthalen-1-yl]ethyl}-1,1,4a-trimethyl-octahydronaphthalene-2,6-diol
(1r,3as,3bs,4r,5r,5ar,7s,9ar,9bs,11ar)-1-[(2r,5s)-5,6-dimethylheptan-2-yl]-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthrene-4,5,5a,7-tetrol
n-{9a,11a-dimethyl-1-[1-(methylamino)ethyl]-tetradecahydro-1h-cyclopenta[a]phenanthren-7-yl}-n-methylbenzamide
C30H46N2O (450.36099459999997)
(1r,3as,3bs,5r,5ar,7s,9ar,9bs,10r,11ar)-1-[(2r,5s)-5,6-dimethylheptan-2-yl]-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthrene-5,5a,7,10-tetrol
(6r,7e,16z,28z)-hentriaconta-7,16,28-trien-2,4,30-triyne-1,6-diol
(1r,5s,7r,10s,11s,14s,15r,16r,18r,23s)-n,n,10,14,16-pentamethyl-19-(propan-2-ylidene)-22-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁵,²³.0¹⁸,²²]tetracos-2-en-7-amine
(4e,6s,7s,8e,10s,11s,12e,14s,15r,16s,18s)-7,11,15-trihydroxy-4,6,8,10,12,14,16,18-octamethylicosa-4,8,12-trien-3-one
(1r,3as,3bs,5r,5ar,7s,9ar,9bs,11ar)-1-[(2r,5s)-6-hydroxy-5,6-dimethylheptan-2-yl]-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthrene-5,5a,7-triol
(1s,3as,3br,5as,7s,9as,9bs,11as)-n-benzyl-1-[(1s)-1-(dimethylamino)ethyl]-n,9a,11a-trimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-7-amine
(3β,8β, 14α, 21α)-26, 27-dinoronocerane-3, 8, 14, 21-tetrol
{"Ingredient_id": "HBIN008119","Ingredient_name": "(3\u03b2,8\u03b2, 14\u03b1, 21\u03b1)-26, 27-dinoronocerane-3, 8, 14, 21-tetrol","Alias": "NA","Ingredient_formula": "C28H50O4","Ingredient_Smile": "CC1(C2CCC(C(C2(CCC1O)C)CCC3C(CCC4C3(CCC(C4(C)C)O)C)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42906","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3β,8β,14α,21β)-26,27-dinoronocerane-3,8,14,21-tetrol
{"Ingredient_id": "HBIN008120","Ingredient_name": "(3\u03b2,8\u03b2,14\u03b1,21\u03b2)-26,27-dinoronocerane-3,8,14,21-tetrol","Alias": "NA","Ingredient_formula": "C28H50O4","Ingredient_Smile": "CC1(C2CCC(C(C2(CCC1O)C)CCC3C(CCC4C3(CCC(C4(C)C)O)C)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42515","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(1r,3as,3bs,5r,5ar,7s,9r,9as,9bs,11ar)-1-[(2r,5s)-5,6-dimethylheptan-2-yl]-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthrene-5,5a,7,9-tetrol
(2s,3r,4r,5s)-2-[(1r,3br,5as,7s,8r,9as,9bs,11as)-7,8-dihydroxy-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-1-yl]-5,6-dimethylheptane-3,4-diol
(6r,28z)-hentriacont-28-en-2,4,16,30-tetrayne-1,6-diol
(1r,3ar,7s,9as,11ar)-1-[(2r,3e,5r)-5-ethyl-6-methylhept-3-en-2-yl]-9a,11a-dimethyl-1h,2h,3h,3ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-7-yl acetate
(2s,3r,4r,5r)-2-[(1r,3as,3br,5as,7s,8r,9as,9bs,11as)-7,8-dihydroxy-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-1-yl]-5,6-dimethylheptane-3,4-diol
(2s,3r,4r,5s)-2-[(1r,3as,3br,5as,7s,8r,9as,9bs,11ar)-7,8-dihydroxy-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-1-yl]-5,6-dimethylheptane-3,4-diol
n-[(1s,3as,3br,5ar,7s,9as,9bs,11as)-1-[(1s)-1-(dimethylamino)ethyl]-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-7-yl]benzenecarboximidic acid
C30H46N2O (450.36099459999997)
n-[(7s,9as,11as)-1-[1-(dimethylamino)ethyl]-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-7-yl]benzenecarboximidic acid
C30H46N2O (450.36099459999997)
n-{1-[1-(dimethylamino)ethyl]-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-7-yl}benzenecarboximidic acid
C30H46N2O (450.36099459999997)
(2r,4as,5r,6s,8ar)-5-{2-[(1r,2s,4ar,6r,8as)-2,6-dihydroxy-5,5,8a-trimethyl-octahydronaphthalen-1-yl]ethyl}-1,1,4a-trimethyl-octahydronaphthalene-2,6-diol
(2s,4as,5r,6s,8ar)-5-{2-[(1r,2s,4ar,6s,8as)-2,6-dihydroxy-5,5,8a-trimethyl-octahydronaphthalen-1-yl]ethyl}-1,1,4a-trimethyl-octahydronaphthalene-2,6-diol
2-{7,8-dihydroxy-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-1-yl}-5,6-dimethylheptane-3,4-diol
2,3,5,6-tetrakis(3-methylbut-2-en-1-yl)-4-[(3-methylbut-2-en-1-yl)oxy]phenol
7,11,15-trihydroxy-4,6,8,10,12,14,16,18-octamethylicosa-4,8,12-trien-3-one
1-(5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthrene-5,5a,7,9-tetrol
(1r,5s,7r,10s,11r,14s,15r,16r,18r,23s)-n,n,10,14,16-pentamethyl-19-(propan-2-ylidene)-22-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁵,²³.0¹⁸,²²]tetracos-2-en-7-amine
2-[(2e,7e)-9-[(1s,4as,8as)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]-3,7-dimethylnona-2,7-dien-1-yl]benzene-1,4-diol
5-[2-(2,6-dihydroxy-5,5,8a-trimethyl-octahydronaphthalen-1-yl)ethyl]-1,1,4a-trimethyl-octahydronaphthalene-2,6-diol
2-methyl-3-(3,7,10,15-tetramethylhexadec-2-en-1-yl)naphthalene-1,4-dione
2-methyl-2-(4,8,12,16-tetramethylheptadeca-3,7,11,15-tetraen-1-yl)-3,4-dihydro-1-benzopyran-6-ol
n-[(1s,3as,3br,5as,7s,9as,9bs,11as)-9a,11a-dimethyl-1-[(1r)-1-(methylamino)ethyl]-tetradecahydro-1h-cyclopenta[a]phenanthren-7-yl]-n-methylbenzamide
C30H46N2O (450.36099459999997)
1-(6-hydroxy-5,6-dimethylheptan-2-yl)-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthrene-5,5a,7-triol
n-[(1s,3as,3br,5as,7s,9as,9bs,11as)-1-[(1s)-1-(dimethylamino)ethyl]-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-7-yl]benzenecarboximidic acid
C30H46N2O (450.36099459999997)