[5-(6-Aminopurin-9-yl)-4-hydroxy-2-[[[[3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-propanoylsulfanylethylamino)propyl]amino]butoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate (BioDeep_00000896570)
代谢物信息卡片
[5-(6-Aminopurin-9-yl)-4-hydroxy-2-[[[[3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-propanoylsulfanylethylamino)propyl]amino]butoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate
化学式: C24H36N7O17P3S-4 (819.1101196000001)
中文名称:
谱图信息:
最多检出来源 Viridiplantae(plant) 50%
分子结构信息
SMILES: CCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)([O-])[O-])O
InChI: InChI=1S/C24H40N7O17P3S/c1-4-15(33)52-8-7-26-14(32)5-6-27-22(36)19(35)24(2,3)10-45-51(42,43)48-50(40,41)44-9-13-18(47-49(37,38)39)17(34)23(46-13)31-12-30-16-20(25)28-11-29-21(16)31/h11-13,17-19,23,34-35H,4-10H2,1-3H3,(H,26,32)(H,27,36)(H,40,41)(H,42,43)(H2,25,28,29)(H2,37,38,39)/p-4
相关代谢途径
Reactome(0)
BioCyc(0)
PlantCyc(0)
代谢反应
56 个相关的代谢反应过程信息。
Reactome(0)
BioCyc(48)
- superpathway of methionine degradation:
S-adenosyl-L-homocysteine + H2O ⟶ L-homocysteine + adenosine - L-valine degradation I:
(S)-methylmalonate-semialdehyde + H2O + NAD+ + coenzyme A ⟶ H+ + NADH + hydrogencarbonate + propanoyl-CoA - valine degradation I:
3-methyl-2-oxobutanoate + NAD+ + coenzyme A ⟶ CO2 + NADH + isobutanoyl-CoA - valine degradation I:
2-oxoisovalerate + NAD+ + coenzyme A ⟶ CO2 + NADH + isobutyryl-CoA - valine degradation I:
3-methyl-2-oxobutanoate + NAD+ + coenzyme A ⟶ CO2 + NADH + isobutanoyl-CoA - methylmalonyl pathway:
ATP + bicarbonate + propanoyl-CoA ⟶ (S)-methylmalonyl-CoA + ADP + H+ + phosphate - valine degradation I:
2-oxoglutarate + val ⟶ 3-methyl-2-oxobutanoate + glt - 3-hydroxypropionate/4-hydroxybutyrate cycle:
ATP + bicarbonate + propanoyl-CoA ⟶ (S)-methylmalonyl-CoA + ADP + H+ + phosphate - methylmalonyl pathway:
ATP + bicarbonate + propanoyl-CoA ⟶ (S)-methylmalonyl-CoA + ADP + H+ + phosphate - isoleucine degradation:
2-oxoglutarate + ile ⟶ 2-keto-3-methyl-valerate + glt - valine degradation I:
2-oxoglutarate + val ⟶ 2-oxoisovalerate + glt - valine degradation:
2-oxoisovalerate + an [apo BCAA dehydrogenase E2 protein] N6-lipoyl-L-lysine ⟶ CO2 + an [apo BCAA dehydrogenase E2 protein] N6-S-[2-methylpropanoyl]dihydrolipoyl-L-lysine - valine degradation I:
2-oxoisovalerate + NAD+ + coenzyme A ⟶ CO2 + NADH + isobutyryl-CoA - methylmalonyl pathway:
ATP + bicarbonate + propanoyl-CoA ⟶ (S)-methylmalonyl-CoA + ADP + H+ + phosphate - pyruvate fermentation to propionate II (acrylate pathway):
acetyl-CoA + propanoate ⟶ acetate + propanoyl-CoA - methylmalonyl pathway:
ATP + bicarbonate + propanoyl-CoA ⟶ (S)-methylmalonyl-CoA + ADP + H+ + phosphate - valine degradation I:
2-oxoglutarate + val ⟶ 2-oxoisovalerate + glt - 3-hydroxypropionate cycle:
ATP + bicarbonate + propanoyl-CoA ⟶ (S)-methylmalonyl-CoA + ADP + H+ + phosphate - valine degradation I:
2-oxoglutarate + val ⟶ 3-methyl-2-oxobutanoate + glt - propionyl CoA degradation:
ATP + hydrogen carbonate + propanoyl-CoA ⟶ (S)-methylmalonyl-CoA + ADP + H+ + phosphate - L-1,2-propanediol degradation:
NAD+ + coenzyme A + propanal ⟶ H+ + NADH + propanoyl-CoA - 2-methylbutyrate biosynthesis:
acetyl-CoA + propionate ⟶ acetate + propanoyl-CoA - superpathway of cholesterol degradation I (cholesterol oxidase):
O2 + cholesterol ⟶ cholest-5-en-3-one + hydrogen peroxide - androstenedione degradation:
5-hydroxy-3-[(3aS,4S,5R,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoyl-CoA + NADP+ ⟶ 3-[(3aS,4S,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoyl-CoA + H+ + NADPH - superpathway of cholesterol degradation II (cholesterol dehydrogenase):
NAD+ + cholesterol ⟶ H+ + NADH + cholest-5-en-3-one - androstenedione degradation:
5-hydroxy-3-[(3aS,4S,5R,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoyl-CoA + NADP+ ⟶ 3-[(3aS,4S,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoyl-CoA + H+ + NADPH - β-alanine biosynthesis II:
ATP + coenzyme A + propanoate ⟶ AMP + diphosphate + propanoyl-CoA - β-alanine biosynthesis II:
ala + malonate semialdehyde ⟶ β-alanine + pyruvate - pantothenate and coenzyme A biosynthesis II:
3-methyl-2-oxobutanoate + 5,10-methylenetetrahydrofolate + H2O ⟶ 2-dehydropantoate + tetrahydrofolate - conversion of succinate to propionate:
(R)-methylmalonyl-CoA + H+ ⟶ CO2 + propionyl-CoA - 2-methylcitrate cycle I:
(2R,3S)-2-methylisocitrate ⟶ pyruvate + succinate - 2-methylcitrate cycle II:
(2R,3S)-2-methylisocitrate ⟶ pyruvate + succinate - 2-methylcitrate cycle I:
(2R,3S)-2-methylisocitrate ⟶ pyruvate + succinate - conversion of succinate to propionate:
(R)-methylmalonyl-CoA + H+ ⟶ CO2 + propanoyl-CoA - β-alanine biosynthesis II:
ala + malonate semialdehyde ⟶ β-alanine + pyruvate - isoleucine biosynthesis IV:
2-oxoglutarate + ile ⟶ (S)-3-methyl-2-oxopentanoate + glt - 2-methylbutyrate biosynthesis:
acetyl-CoA + propionate ⟶ acetate + propanoyl-CoA - 2-methylcitrate cycle I:
ATP + coenzyme A + propionate ⟶ AMP + H+ + diphosphate + propanoyl-CoA - isoleucine biosynthesis IV:
2-oxoglutarate + ile ⟶ 2-keto-3-methyl-valerate + glt - conversion of succinate to propionate:
(R)-methylmalonyl-CoA + H+ ⟶ CO2 + propanoyl-CoA - 2-methylcitrate cycle I:
(2R,3S)-2-methylisocitrate ⟶ pyruvate + succinate - conversion of succinate to propionate:
(R)-methylmalonyl-CoA + H+ ⟶ CO2 + propanoyl-CoA - 2-methylcitrate cycle I:
(2R,3S)-2-methylisocitrate ⟶ pyruvate + succinate - conversion of succinate to propionate:
(R)-methylmalonyl-CoA + H+ ⟶ CO2 + propanoyl-CoA - pyruvate fermentation to propionate I:
(S)-malate ⟶ H2O + fumarate - 2-methylbutyrate biosynthesis:
acetyl-CoA + propionate ⟶ acetate + propanoyl-CoA - pyruvate fermentation to propionate I:
MQH2 + fumarate ⟶ MQ + succinate - conversion of succinate to propionate:
(R)-methylmalonyl-CoA + H+ ⟶ CO2 + propanoyl-CoA
WikiPathways(0)
Plant Reactome(0)
INOH(0)
PlantCyc(8)
- volatile esters biosynthesis (during fruit ripening):
ethanol + propanoyl-CoA ⟶ coenzyme A + ethyl propanoate - L-valine degradation I:
(S)-methylmalonate-semialdehyde + H2O + NAD+ + coenzyme A ⟶ H+ + NADH + hydrogencarbonate + propanoyl-CoA - L-valine degradation I:
3-methyl-2-oxobutanoate + NAD+ + coenzyme A ⟶ CO2 + NADH + isobutanoyl-CoA - L-valine degradation I:
3-methyl-2-oxobutanoate + NAD+ + coenzyme A ⟶ CO2 + NADH + isobutanoyl-CoA - L-valine degradation I:
(S)-methylmalonate-semialdehyde + H2O + NAD+ + coenzyme A ⟶ H+ + NADH + hydrogencarbonate + propanoyl-CoA - L-valine degradation I:
2-oxoglutarate + val ⟶ 3-methyl-2-oxobutanoate + glu - β-alanine biosynthesis II:
3-oxopropanoate + ala ⟶ β-alanine + pyruvate - L-valine degradation I:
3-methyl-2-oxobutanoate + NAD+ + coenzyme A ⟶ CO2 + NADH + isobutanoyl-CoA
COVID-19 Disease Map(0)
PathBank(0)
PharmGKB(0)
0 个相关的物种来源信息
在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有：
- PubMed: 来源于PubMed文献库中的文献信息，我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表，这个列表按照代谢物同时出现的文献数量降序排序，取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
- NCBI Taxonomy: 通过文献数据挖掘，得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序，取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
- Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
- Chemical Reaction: 在化学反应过程中，存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。
点击图上的相关代谢物的名称，可以跳转到相关代谢物的信息页面。