beta-Alanine metabolism

Source	ID	Pathway
PathWhiz	PW002381
KEGG	00410

Pathway Metabolites

YMDB ID	Name CAS Number	IUPAC Name	Formula Weight
YMDB00007	Quinolinic acid 89-00-9	pyridine-2,3-dicarboxylic acid	C₇H₅NO₄ 167.1189
YMDB00042	1,3-Diaminopropane 109-76-2	propane-1,3-diamine	C₃H₁₀N₂ 74.1249
YMDB00045	Coenzyme A 85-61-0	{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid	C₂₁H₃₆N₇O₁₆P₃S 767.534
YMDB00046	L-Cysteine 52-90-4	(2R)-2-amino-3-sulfanylpropanoic acid	C₃H₇NO₂S 121.158
YMDB00048	3-Aminopropionaldehyde 352-92-1	3-aminopropanal	C₃H₇NO 73.0938
YMDB00097	Adenosine monophosphate 61-19-8	{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid	C₁₀H₁₄N₅O₇P 347.2212
YMDB00098	Uracil 66-22-8	1,2,3,4-tetrahydropyrimidine-2,4-dione	C₄H₄N₂O₂ 112.0868
YMDB00109	Adenosine triphosphate 56-65-5	({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid	C₁₀H₁₆N₅O₁₃P₃ 507.181
YMDB00130	S-Adenosylmethioninamine 22365-13-5	{[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl}(3-aminopropyl)methylsulfanium	C₁₄H₂₃N₆O₃S 355.436
YMDB00132	Putrescine 110-60-1	butane-1,4-diamine	C₄H₁₂N₂ 88.1515
YMDB00178	5'-Methylthioadenosine 2457-80-9	(2R,3R,4S,5S)-2-(6-amino-9H-purin-9-yl)-5-[(methylsulfanyl)methyl]oxolane-3,4-diol	C₁₁H₁₅N₅O₃S 297.334
YMDB00195	Beta-Alanine 107-95-9	3-aminopropanoic acid	C₃H₇NO₂ 89.0932
YMDB00203	(R)-Pantothenic acid 79-83-4	3-[(2R)-2,4-dihydroxy-3,3-dimethylbutanamido]propanoic acid	C₉H₁₇NO₅ 219.235
YMDB00219	Pyrophosphate 14000-31-8	(phosphonooxy)phosphonic acid	H₄O₇P₂ 177.9751
YMDB00231	Spermine 71-44-3	(3-aminopropyl)({4-[(3-aminopropyl)amino]butyl})amine	C₁₀H₂₆N₄ 202.3402
YMDB00232	Spermidine 124-20-9	(4-aminobutyl)(3-aminopropyl)amine	C₇H₁₉N₃ 145.2459
YMDB00272	D-4'-Phosphopantothenate	3-{2-hydroxy-3-methyl-3-[(phosphonooxy)methyl]butanamido}propanoic acid	C₉H₁₈NO₈P 299.2149
YMDB00279	Cytidine triphosphate 65-47-4	({[({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid	C₉H₁₆N₃O₁₄P₃ 483.1563
YMDB00297	S-Adenosylmethionine 29908-03-0	[(3S)-3-amino-3-carboxypropyl]({[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl})methylsulfanium	C₁₅H₂₃N₆O₅S 399.445
YMDB00308	Pantetheine 4'-phosphate 2226-71-3	[3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphonic acid	C₁₁H₂₃N₂O₇PS 358.348
YMDB00312	Acetyl-CoA 72-89-9	{[(2R,3S,4R,5R)-2-({[({[(3R)-3-[(2-{[2-(acetylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]-3-hydroxy-2,2-dimethylpropoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]oxy}methyl)-5-(6-amino-9H-purin-9-yl)-4-hydroxyoxolan-3-yl]oxy}phosphonic acid	C₂₃H₃₈N₇O₁₇P₃S 809.571
YMDB00318	L-Methionine 63-68-3	(2S)-2-amino-4-(methylsulfanyl)butanoic acid	C₅H₁₁NO₂S 149.211
YMDB00335	gamma-Aminobutyric acid 56-12-2	4-aminobutanoic acid	C₄H₉NO₂ 103.1198
YMDB00353	Ornithine 70-26-8	(2S)-2,5-diaminopentanoic acid	C₅H₁₂N₂O₂ 132.161
YMDB00357	Dephospho-CoA 3633-59-8	[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy][3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphinic acid	C₂₁H₃₅N₇O₁₃P₂S 687.554
YMDB00369	L-Histidine 71-00-1	(2S)-2-amino-3-(1H-imidazol-5-yl)propanoic acid	C₆H₉N₃O₂ 155.1546
YMDB00376	(R)-Pantoic acid 470-29-1	(2R)-2,4-dihydroxy-3,3-dimethylbutanoic acid	C₆H₁₂O₄ 148.1571
YMDB00400	4-Phosphopantothenoylcysteine 7196-09-0	(2R)-2-{3-[(2R)-2-hydroxy-3-methyl-3-[(phosphonooxy)methyl]butanamido]propanamido}-3-sulfanylpropanoic acid	C₁₂H₂₃N₂O₉PS 402.358
YMDB00406	Cytidine monophosphate 63-37-6	{[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid	C₉H₁₄N₃O₈P 323.1965
YMDB00426	NADPH 53-57-6	{[(2R,3R,4R,5R)-2-(6-amino-9H-purin-9-yl)-5-[({[({[(2R,3S,4R,5R)-5-(3-carbamoyl-1,4-dihydropyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)methyl]-4-hydroxyoxolan-3-yl]oxy}phosphonic acid	C₂₁H₃₀N₇O₁₇P₃ 745.4209
YMDB00427	NADP 53-59-8	1-[(2R,3R,4S,5R)-5-[({[({[(2R,3R,4R,5R)-5-(6-amino-9H-purin-9-yl)-3-hydroxy-4-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)methyl]-3,4-dihydroxyoxolan-2-yl]-3-carbamoyl-1lambda5-pyridin-1-ylium	C₂₁H₂₉N₇O₁₇P₃ 744.4129
YMDB00438	S-Adenosyl-L-methionine 29908-03-0	[(3S)-3-amino-3-carboxypropyl]({[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl})methylsulfanium	C₁₅H₂₃N₆O₅S 399.445
YMDB00446	propionyl-CoA 317-66-8	{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-[(2-{[2-(propanoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid	C₂₄H₄₀N₇O₁₇P₃S 823.597
YMDB00533	malonyl-CoA 524-14-1	3-[(2-{3-[(2R)-3-[({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)methyl]-2-hydroxy-3-methylbutanamido]propanamido}ethyl)sulfanyl]-3-oxopropanoic acid	C₂₄H₃₈N₇O₁₉P₃S 853.58
YMDB00587	4-aminobutanal 4390-05-0	4-aminobutanal	C₄H₉NO 87.1204
YMDB00664	3'-Dephospho-CoA 3633-59-8	[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy][(3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-sulfanylethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphinic acid	C₂₁H₃₅N₇O₁₃P₂S 687.554
YMDB00749	(R)-4'-phosphopantothenic acid	3-[(2R)-2-hydroxy-3-methyl-3-[(phosphonooxy)methyl]butanamido]propanoic acid	C₉H₁₈NO₈P 299.2149
YMDB00862	hydron 12408-02-5	hydron	H 1.00794
YMDB00888	Hydrogen peroxide 7722-84-1	peroxol	H₂O₂ 34.0147
YMDB00890	water 7732-18-5	water	H₂O 18.0153
YMDB00896	L-Aspartic acid 56-84-8	(2S)-2-aminobutanedioic acid	C₄H₇NO₄ 133.1027
YMDB00900	oxygen 7782-44-7	dioxygen	O₂ 31.9988
YMDB00907	phosphate 14265-44-2	phosphoric acid	O₄P 94.9714
YMDB00912	Carbon dioxide 124-38-9	methanedione	CO₂ 44.0095
YMDB00914	ADP 58-64-0	[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid	C₁₀H₁₅N₅O₁₀P₂ 427.2011
YMDB00980	(5-Deoxy-5-adenosyl)(3-aminopropyl)methylsulfonium 22365-13-5	{[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl}(3-aminopropyl)methylsulfanium	C₁₄H₂₃N₆O₃S 355.436
YMDB01009	(R)-Pantothenate 79-83-4		C₉H₁₆NO₅ 218.227
YMDB01012	(R)-Pantoate 470-29-1		C₆H₁₁O₄ 147.1491
YMDB01522	Pantothenic acid 79-83-4		C₉H₁₇NO₅ 219.235
YMDB16264	4'-phosphopantetheine	2,3,3-trimethyl-4-(phosphonatooxy)-N-{2-[(2-sulfanylethyl)carbamoyl]ethyl}butanamide	C₁₂H₂₃N₂O₆PS 354.36

Pathway Proteins

Uniprot ID	Gene Name Locus	Name	Type	Metabolites
P46367	ALD4 YOR374W	Potassium-activated aldehyde dehydrogenase, mitochondrial	Enzyme	Acetaldehyde Coenzyme A Acetic acid NAD NADH Acetyl-CoA gamma-Aminobutyric acid Indoleacetaldehyde NAD(+) NADPH NADP indole-3-acetate 4-aminobutanal hydron water
P54114	ALD3 YMR169C	Aldehyde dehydrogenase [NAD(P)+] 2	Enzyme	Acetaldehyde 3-Aminopropionaldehyde Acetic acid NAD Phenylacetaldehyde NADH Beta-Alanine NAD(+) NADPH NADP hydron water Phenylacetic acid Glyceric acid Glyceraldehyde
P54115	ALD6 YPL061W	Magnesium-activated aldehyde dehydrogenase, cytosolic	Enzyme	Acetaldehyde Coenzyme A Acetic acid NAD NADH Acetyl-CoA Indoleacetaldehyde NADPH NADP indole-3-acetate hydron water
P50264	FMS1 YMR020W	Polyamine oxidase FMS1	Enzyme	1,3-Diaminopropane 3-Aminopropionaldehyde Putrescine 4-acetamidobutanal Spermine Spermidine Acetamidopropanal N8-Acetylspermidine N1-Acetylspermine N1-Acetylspermidine N-Acetylputrescine Hydrogen peroxide water oxygen
P28817	EHD3 YDR036C	3-hydroxyisobutyryl-CoA hydrolase, mitochondrial	Enzyme	Coenzyme A (S)-3-Hydroxyisobutyryl-CoA (2E)-Dodecenoyl-CoA (S)-3-Hydroxyisobutyric acid (S)-3-hydroxydecanoyl-CoA (S)-3-hydroxylauroyl-CoA (S)-3-hydroxypalmitoyl-CoA hexadec-2-enoyl-CoA (S)-3-hydroxytetradecanoyl-CoA water 3-Hydroxybutyryl-CoA Crotonoyl-CoA (S)-Hydroxyoctanoyl-CoA (S)-Hydroxyhexanoyl-CoA trans-2-Hexenoyl-CoA (2E)-Tetradecenoyl-CoA (2E)-Decenoyl-CoA (2E)-Octenoyl-CoA
Q03941	CAB5 YDR196C	Dephospho-CoA kinase CAB5	Enzyme	Coenzyme A Adenosine triphosphate Dephospho-CoA hydron ADP
P40506	YIL083C	Uncharacterized protein YIL083C	Enzyme	L-Cysteine Pyrophosphate D-4'-Phosphopantothenate Cytidine triphosphate 4-Phosphopantothenoylcysteine Cytidine monophosphate hydron Carbon dioxide 4'-phosphopantetheine
P10659	SAM1 YLR180W	S-adenosylmethionine synthase 1	Enzyme	Adenosine triphosphate Pyrophosphate S-Adenosylmethionine L-Methionine S-Adenosyl-L-methionine water phosphate
P53332	YGR277C	Uncharacterized protein YGR277C	Enzyme	Adenosine triphosphate Pyrophosphate Pantetheine 4'-phosphate Dephospho-CoA hydron 4'-phosphopantetheine
Q04430	YDR531W	Pantothenate kinase	Enzyme	Adenosine triphosphate (R)-Pantothenic acid D-4'-Phosphopantothenate (R)-4'-phosphopantothenic acid hydron ADP Pantothenic acid
P22281	ALD1	Aldehyde dehydrogenase 1, mitochondrial	Enzyme	NAD NADH
Q12455	SPE4 YLR146C	Spermine synthase	Enzyme	S-Adenosylmethioninamine 5'-Methylthioadenosine Spermine Spermidine hydron
Q12074	SPE3 YPR069C	Spermidine synthase	Enzyme	S-Adenosylmethioninamine Putrescine 5'-Methylthioadenosine Spermidine hydron
P21182	SPE2 YOL052C	S-adenosylmethionine decarboxylase proenzyme	Enzyme	S-Adenosylmethioninamine S-Adenosylmethionine S-Adenosyl-L-methionine hydron Carbon dioxide (5-Deoxy-5-adenosyl)(3-aminopropyl)methylsulfonium
P08432	SPE1 YKL184W	Ornithine decarboxylase	Enzyme	Putrescine Ornithine hydron Carbon dioxide
P17649	UGA1 YGR019W	4-aminobutyrate aminotransferase	Enzyme	Oxoglutaric acid Succinic acid semialdehyde L-Glutamic acid gamma-Aminobutyric acid 4-(Glutamylamino) butanoate
Q04792	GAD1 YMR250W	Glutamate decarboxylase	Enzyme	Beta-Alanine L-Glutamic acid gamma-Aminobutyric acid Taurine hydron L-Aspartic acid Carbon dioxide Hypotaurine 3-Sulfinoalanine Cysteic acid 4-(Glutamylamino) butanoate
P19358	SAM2 YDR502C	S-adenosylmethionine synthase 2	Enzyme	Adenosine triphosphate Pyrophosphate S-Adenosylmethionine L-Methionine S-Adenosyl-L-methionine water phosphate
P40459	PAN6 YIL145C	Pantoate--beta-alanine ligase	Enzyme	Adenosine monophosphate Adenosine triphosphate Beta-Alanine (R)-Pantothenic acid Pyrophosphate (R)-Pantoic acid hydron (R)-Pantoate Pantothenic acid
P36024	SIS2	Phosphopantothenoylcysteine decarboxylase subunit SIS2		4-Phosphopantothenoylcysteine hydron Carbon dioxide 4'-phosphopantetheine
P36076	CAB3	Coenzyme A biosynthesis protein 3		4-Phosphopantothenoylcysteine hydron Carbon dioxide 4'-phosphopantetheine
Q08438	VHS3	Phosphopantothenoylcysteine decarboxylase subunit VHS3		4-Phosphopantothenoylcysteine hydron Carbon dioxide 4'-phosphopantetheine