Molecule

3-Aminopropanoic acid

AlkaPlorer ID: AK000628

Synonym: β-Alanine, Abufene, FEMA 3252

IUPAC Name: 3-aminopropanoic acid

Structure

SMILES: NCCC(=O)O

InChI: InChI=1S/C3H7NO2/c4-2-1-3(5)6/h1-2,4H2,(H,5,6)

InChIKey: UCMIRNVEIXFBKS-UHFFFAOYSA-N

Reference

Comparative ionomics and metabolomics in extremophile and glycophytic <i>Lotus</i> species under salt stress challenge the metabolic pre‐adaptation hypothesis

PubChem CID: 175912041

CAS: 107-95-9

LOTUS: LTS0209241

SuperNatural Ⅲ: SN0366739

NPASS: NPC114517

COCONUT: CNP0226336

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Iris tectorum	Iris	Iridaceae	Asparagales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Ribes nigrum	Ribes	Grossulariaceae	Saxifragales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Homo sapiens	Homo	Hominidae	Primates	Mammalia	Chordata	Metazoa	Eukaryota
Saccharomyces cerevisiae	Saccharomyces	Saccharomycetaceae	Saccharomycetales	Saccharomycetes	Ascomycota	Fungi	Eukaryota
Mus musculus	Mus	Muridae	Rodentia	Mammalia	Chordata	Metazoa	Eukaryota
Iris tingitana	Iris	Iridaceae	Asparagales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Escherichia coli	Escherichia	Enterobacteriaceae	Enterobacterales	Gammaproteobacteria	Pseudomonadota	None	Bacteria
Pogostemon cablin	Pogostemon	Lamiaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 89.09399999999998

TPSA？: 63.32000000000001

MolLogP？: -0.5802

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 0

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Bacillus anthracis	Anthrax lethal factor	Potency	12589.3	nM	None
Homo sapiens	Cytochrome P450 1A2	AC50	nan	None	None
Homo sapiens	Cytochrome P450 2C19	AC50	nan	None	None
Homo sapiens	Cytochrome P450 2C9	AC50	nan	None	None
Homo sapiens	Cytochrome P450 2D6	AC50	nan	None	None
Homo sapiens	Cytochrome P450 3A4	AC50	nan	None	None
Homo sapiens	GABA transporter 2	IC50	100000.0	nM	10.1021/ml500134k
Homo sapiens	GABA transporter 2	IC50	209000.0	nM	10.1016/j.bmc.2013.06.063
Homo sapiens	GABA transporter 3	IC50	41200.0	nM	10.1016/j.bmc.2013.06.063
Homo sapiens	GABA transporter 3	IC50	41200.0	nM	10.1021/ml500134k
Homo sapiens	Proton-coupled amino acid transporter 1	Ki	2400000.0	nM	10.1016/j.bmc.2011.08.058
Homo sapiens	Proton-coupled amino acid transporter 1	pKi	-0.38	mM	10.1016/j.bmc.2011.08.058
Homo sapiens	Regulator of G-protein signaling 4	Potency	2993.5	nM	None
Homo sapiens	SLC16A10 protein	Activity	nan	None	10.1006/geno.2001.6678
Mus musculus	GABA transporter 1	IC50	2570395.78	nM	10.1016/j.ejmech.2011.01.042
Mus musculus	GABA transporter 1	IC50	2818382.93	nM	10.1016/j.ejmech.2013.04.063
Mus musculus	GABA transporter 1	IC50	2951209.23	nM	10.1016/j.ejmech.2019.111920
Mus musculus	GABA transporter 2	IC50	331131.12	nM	10.1016/j.ejmech.2013.04.063
Mus musculus	GABA transporter 3	IC50	21877.62	nM	10.1016/j.ejmech.2013.04.063
Mus musculus	GABA transporter 3	IC50	66069.34	nM	10.1016/j.ejmech.2019.111920
Mus musculus	GABA transporter 3	IC50	331131.12	nM	10.1016/j.ejmech.2011.01.042
Mus musculus	GABA transporter 3	IC50	1096478.2	nM	10.1016/j.ejmech.2019.111920
Mus musculus	GABA transporter 4	IC50	21877.62	nM	10.1016/j.ejmech.2011.01.042
Mus musculus	GABA transporter 4	IC50	34673.69	nM	10.1016/j.ejmech.2013.04.063
Mus musculus	GABA transporter 4	IC50	109647.82	nM	10.1016/j.ejmech.2019.111920
Mycobacterium tuberculosis	Pantothenate synthetase	Activity	12.31	%	10.1016/j.bmcl.2011.05.021
Mycobacterium tuberculosis	Pantothenate synthetase	Activity	22.0	%	10.1016/j.bmcl.2011.05.021
Mycobacterium tuberculosis	Pantothenate synthetase	Activity	36.77	%	10.1016/j.bmcl.2011.05.021
Mycobacterium tuberculosis	Pantothenate synthetase	Activity	38.0	%	10.1016/j.bmcl.2011.05.021
Mycobacterium tuberculosis	Pantothenate synthetase	Activity	nan	None	10.1016/j.bmcl.2011.05.021
Rattus norvegicus	Glutamate (NMDA) receptor subunit zeta 1	IC50	11600.0	nM	10.1021/jm00080a006
None	CD40 mRNA	UTC	43.0	%	10.1021/jm050490b
None	CD40 mRNA	UTC	73.0	%	10.1021/jm050490b
None	CD40 mRNA	UTC	95.0	%	10.1021/jm050490b
None	Hairpin ribozyme RNA	K obs	0.018	None	10.1016/s0960-894x(01)00608-4
None	Hairpin ribozyme RNA	K obs	0.03	None	10.1016/s0960-894x(01)00608-4
None	No relevant target	pKa	10.2	None	10.1007/s11095-013-1232-z
None	Unchecked	EC50	20.0	%	10.1016/s0960-894x(03)00280-4
None	Unchecked	IC50	34673.69	nM	10.1016/j.ejmech.2011.01.042

Metabolism Information

AKRT ID	Reaction	Reaction Link ID
AKRT002081	CC(=O)C(=O)O.NCCC(=O)O>>C[C@@H](NCCC(=O)O)C(=O)O	BETA-ALANOPINE-DEHYDROGENASE-RXN
AKRT002082	CC(=O)C(=O)O.NCCC(=O)O>>C[C@H](N)C(=O)O.O=CCC(=O)O	None
AKRT002217	CC(=O)CC(=O)O.NCCC(=O)O>>CC(N)CC(=O)O	enzymemap_41723
AKRT002393	CC(=O)NCCC(=O)O>>NCCC(=O)O	R00909
AKRT003633	CC(=O)N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O.NCCC(=O)O>>CC(=O)N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)NCCC(=O)O	enzymemap_91037
AKRT004870	CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)O>>NCCC(=O)O	R02474
AKRT004874	CC(C)(CO)[C@@H](O)C(=O)O.NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT004875	CC(C)(CO)[C@@H](O)C(=O)O.NCCC(=O)O>>CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)O	PANTOATE-BETA-ALANINE-LIG-RXN
AKRT004909	CC(C)(COP(=O)(O)O)[C@@H](O)C(=O)O.NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>CC(C)(COP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT004910	CC(C)(COP(=O)(O)O)[C@@H](O)C(=O)O.NCCC(=O)O>>CC(C)(COP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)O	RXN-11781
AKRT005767	CC(C)C[C@H](N)C(=O)O.NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>CC(C)C[C@H](NC(=O)CCN)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT005768	CC(C)C[C@H](N)C(=O)O.NCCC(=O)O>>CC(C)C[C@H](NC(=O)CCN)C(=O)O	enzymemap_90795
AKRT005834	CC(C)C[C@H](NC(=O)CCN)C(=O)O>>CC(C)C[C@H](N)C(=O)O.NCCC(=O)O	None
AKRT005835	CC(C)C[C@H](NC(=O)CCN)C(=O)O>>NCCC(=O)O	enzymemap_66474
AKRT006274	CC(C)[C@H](N)C(=O)O.NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>CC(C)[C@H](NC(=O)CCN)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT006275	CC(C)[C@H](N)C(=O)O.NCCC(=O)O>>CC(C)[C@H](NC(=O)CCN)C(=O)O	enzymemap_90858
AKRT006842	CC1(C)COC(=O)[C@@H]1O.NCCC(=O)O>>CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)O	RXN-6401
AKRT007338	CCC=O.NCCC(=O)O>>CCCN.O=CCC(=O)O	None
AKRT009430	CCCCCc1cc(=O)cc2oc3cc(NC(=O)CCN)ccc3nc1-2>>NCCC(=O)O	enzymemap_65312
AKRT009431	CCCCCc1cc2nc3cc(NC(=O)CCN)ccc3oc-2cc1=O>>NCCC(=O)O	enzymemap_65315
AKRT009432	CCCCCc1cc2nc3ccc(NC(=O)CCN)cc3oc-2cc1=O>>NCCC(=O)O	enzymemap_65313
AKRT009514	CCCCc1cc2nc3cc(NC(=O)CCN)ccc3oc-2cc1=O>>NCCC(=O)O	enzymemap_65314
AKRT009976	CC[C@H](C)[C@H](N)C(=O)O.NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>CC[C@H](C)[C@H](NC(=O)CCN)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT009977	CC[C@H](C)[C@H](N)C(=O)O.NCCC(=O)O>>CC[C@H](C)[C@H](NC(=O)CCN)C(=O)O	enzymemap_90794
AKRT010037	CC[C@H](C)[C@H](NC(=O)CCN)C(=O)N[C@H](CC(=O)O)Cc1ccc(O)cc1>>CC[C@H](C)[C@H](N)C(=O)N[C@H](CC(=O)O)Cc1ccc(O)cc1.NCCC(=O)O	None
AKRT010038	CC[C@H](C)[C@H](NC(=O)CCN)C(=O)N[C@H](CC(=O)O)Cc1ccc(O)cc1>>NCCC(=O)O	enzymemap_65809
AKRT012373	CSCC[C@H](N)C(=O)O.NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>CSCC[C@H](NC(=O)CCN)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT012374	CSCC[C@H](N)C(=O)O.NCCC(=O)O>>CSCC[C@H](NC(=O)CCN)C(=O)O	enzymemap_90798
AKRT012813	C[C@@H](NCCC(=O)O)C(=O)O>>NCCC(=O)O	enzymemap_22890
AKRT012903	C[C@@H](O)[C@H](N)C(=O)O.NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>C[C@@H](O)[C@H](NC(=O)CCN)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT012904	C[C@@H](O)[C@H](N)C(=O)O.NCCC(=O)O>>C[C@@H](O)[C@H](NC(=O)CCN)C(=O)O	enzymemap_90829
AKRT013350	C[C@H](CCC(=O)[CoA])[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O.NCCC(=O)O>>C[C@H](CCC(=O)NCCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O	enzymemap_31612
AKRT013631	C[C@H](N)C(=O)O.O=CCC(=O)O>>NCCC(=O)O	R00907
AKRT013657	C[C@H](N)C(=O)O>>NCCC(=O)O	enzymemap_88234
AKRT013697	C[C@H](NC(=O)CCN)C(=O)O>>C[C@H](N)C(=O)O.NCCC(=O)O	None
AKRT013698	C[C@H](NC(=O)CCN)C(=O)O>>NCCC(=O)O	enzymemap_66444
AKRT014643	C[SAH].NCCC(=O)O>>CNCCC(=O)O	RXN-6461
AKRT014842	Cc1c2nc3ccc(NC(=O)CCN)cc3oc-2c(C)c(=O)c1C>>NCCC(=O)O	enzymemap_65311
AKRT014843	Cc1c2nc3ccc(NC(=O)CCN)cc3oc-2cc(=O)c1C>>NCCC(=O)O	enzymemap_65310
AKRT015539	Cn1cnc(C[C@H](N)C(=O)O)c1.NCCC(=O)O>>Cn1cnc(C[C@H](NC(=O)CCN)C(=O)O)c1	enzymemap_90295
AKRT015559	Cn1cncc1C[C@H](N)C(=O)O.NCCC(=O)O>>Cn1cncc1C[C@H](NC(=O)CCN)C(=O)O	R03286
AKRT015561	Cn1cncc1C[C@H](NC(=O)CCN)C(=O)O>>NCCC(=O)O	R03288
AKRT015617	N#CCCN>>NCCC(=O)O	enzymemap_79467
AKRT015857	N=C(N)NCCC(=O)O>>NC(N)=O.NCCC(=O)O	None
AKRT015858	N=C(N)NCCC(=O)O>>NCCC(=O)O	enzymemap_78722
AKRT015935	N=C(N)NCCC[C@@H](N)C(=O)O.NCCC(=O)O>>N=C(N)NCCC[C@H](NC(=O)CCN)C(=O)O	MNXR173358
AKRT016030	N=C(N)NCCC[C@H](N)C(=O)O.NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>N=C(N)NCCC[C@H](NC(=O)CCN)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT016031	N=C(N)NCCC[C@H](N)C(=O)O.NCCC(=O)O>>N=C(N)NCCC[C@H](NC(=O)CCN)C(=O)O	R00912
AKRT016116	N=C(N)NCCC[C@H](NC(=O)CCN)C(=O)O>>NCCC(=O)O	R03935
AKRT017061	NC(=O)NCCC(=O)O>>NCCC(=O)O	BETA-UREIDOPROPIONASE-RXN
AKRT017062	NC(=O)NCCC(=O)O>>NCCC(=O)O.O=C=O	None
AKRT017447	NC(N)=O.NCCC(=O)O>>N=C(N)NCCC(=O)O	GUANIDINOPROPIONASE-RXN
AKRT017801	NCCC(=O)NCC(=O)O>>NCC(=O)O.NCCC(=O)O	None
AKRT017802	NCCC(=O)NCC(=O)O>>NCCC(=O)O	enzymemap_66472
AKRT017803	NCCC(=O)NCCC(=O)O>>NCCC(=O)O	enzymemap_66471
AKRT017804	NCCC(=O)NCCC(=O)O>>NCCC(=O)O.NCCC(=O)O	None
AKRT017805	NCCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O>>NCCC(=O)O	R01166
AKRT017807	NCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O>>NCCC(=O)O	enzymemap_66443
AKRT017809	NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O>>NCCC(=O)O	enzymemap_65807
AKRT017810	NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O>>NCCC(=O)O.N[C@@H](Cc1cnc[nH]1)C(=O)O	None
AKRT017812	NCCC(=O)Nc1ccc([N+](=O)[O-])cc1>>NCCC(=O)O	enzymemap_65810
AKRT017813	NCCC(=O)Nc1ccc([N+](=O)[O-])cc1>>NCCC(=O)O.Nc1ccc([N+](=O)[O-])cc1	None
AKRT017814	NCCC(=O)O.N=C(N)NCCC[C@H](N)C(=O)O>>N=C(N)NCCC(=O)O	enzymemap_28158
AKRT017815	NCCC(=O)O.N=C(N)NCCC[C@H](N)C(=O)O>>N=C(N)NCCC[C@H](NC(=O)CCN)C(=O)O	enzymemap_90775
AKRT017816	NCCC(=O)O.NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>NCCC(=O)NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT017817	NCCC(=O)O.NCCC(=O)O>>NCCC(=O)NCCC(=O)O	enzymemap_90707
AKRT017818	NCCC(=O)O.NCCCC[C@H](N)C(=O)O>>NCCCC[C@@H](NC(=O)CCN)C(=O)O	enzymemap_90300
AKRT017819	NCCC(=O)O.NCCCC[C@H](N)C(=O)O>>NCCCC[C@H](NC(=O)CCN)C(=O)O	R00910
AKRT017820	NCCC(=O)O.NCCC[C@H](N)C(=O)O>>NCCC[C@@H](NC(=O)CCN)C(=O)O	enzymemap_90301
AKRT017821	NCCC(=O)O.NCCC[C@H](N)C(=O)O>>NCCC[C@H](NC(=O)CCN)C(=O)O	59588
AKRT017822	NCCC(=O)O.N[C@@H](CCC(=O)N[C@@H](CS)C(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCCC(=O)O)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT017823	NCCC(=O)O.N[C@@H](CCC(=O)N[C@@H](CS)C(=O)O)C(=O)O>>N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCCC(=O)O)C(=O)O	HOMOGLUTATHIONE-SYNTHASE-RXN
AKRT017824	NCCC(=O)O.N[C@@H](CCC[C@H](N)C(=O)O)C(=O)O>>NCCC(=O)N[C@@H](CCC[C@H](N)C(=O)O)C(=O)O	enzymemap_90306
AKRT017825	NCCC(=O)O.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>NCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT017826	NCCC(=O)O.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O>>NCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O	enzymemap_90830
AKRT017827	NCCC(=O)O.N[C@@H](Cc1c[nH]cn1)C(=O)O>>NCCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O	CARNOSINE-SYNTHASE-RXN
AKRT017828	NCCC(=O)O.N[C@@H](Cc1cnc[nH]1)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O>>NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT017829	NCCC(=O)O.N[C@@H](Cc1cnc[nH]1)C(=O)O>>NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O	enzymemap_90287
AKRT017830	NCCC(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O.O=C(O)[C@@H]1CCCN1>>NCCC(=O)N1CCC[C@H]1C(=O)O.Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O	None
AKRT017831	NCCC(=O)O.O=C(O)CC(=O)C(=O)O>>N[C@@H](CC(=O)O)C(=O)O	enzymemap_41737
AKRT017832	NCCC(=O)O.O=C(O)CCC(=O)C(=O)O>>NC[C@@H](O)C(=O)O.O=C(O)CCC(=O)O.O=C=O	None
AKRT017833	NCCC(=O)O.O=C(O)CCC(=O)C(=O)O>>N[C@@H](CCC(=O)O)C(=O)O	RXN-2901
AKRT017834	NCCC(=O)O.O=C(O)CCC(=O)C(=O)O>>N[C@@H](CCC(=O)O)C(=O)O.O=CCC(=O)O	None
AKRT017835	NCCC(=O)O.O=C(O)CCC(=O)C(=O)O>>O=CCC(=O)O	RXN-2901
AKRT017836	NCCC(=O)O.O=C(O)[C@@H]1CCCN1>>NCCC(=O)N1CCC[C@H]1C(=O)O	enzymemap_90816
AKRT017837	NCCC(=O)O.O=C=O>>NC(=O)NCCC(=O)O	R00905
AKRT017838	NCCC(=O)O.[CoA]>>CC(N)C(=O)[CoA]	MNXR134237
AKRT017839	NCCC(=O)O>>CC(N)C(=O)[CoA]	MNXR134237
AKRT017840	NCCC(=O)O>>N#CCCN	MNXR134238
AKRT017841	NCCC(=O)O>>NC[C@@H](O)C(=O)O	enzymemap_10613
AKRT017842	NCCC(=O)O>>O=CCC(=O)O	2.6.1.18-RXN
AKRT017843	NCCC(=O)[CoA]>>NCCC(=O)O	enzymemap_77595
AKRT017847	NCCC(N)=O>>NCCC(=O)O	enzymemap_66475
AKRT017857	NCCC=O>>NCCC(=O)O	RXN-6382
AKRT018146	NCCCC[C@H](NC(=O)CCN)C(=O)O>>NCCC(=O)O	R00910
AKRT018272	NCCC[C@H](NC(=O)CCN)C(=O)O>>NCCC(=O)O	59612
AKRT018711	N[C@@H](CC(=O)O)C(=O)O>>NCCC(=O)O	ASPDECARBOX-RXN
AKRT018712	N[C@@H](CC(=O)O)C(=O)O>>NCCC(=O)O.O=C=O	None
AKRT018775	N[C@@H](CCC(=O)NCCC(=O)O)C(=O)O>>NCCC(=O)O	enzymemap_85825
AKRT022791	O=C(O)CCNC(=O)CCCCC1SCC2NC(=O)NC21>>NCCC(=O)O	enzymemap_76266
AKRT022793	O=C(O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1>>NCCC(=O)O	enzymemap_67404
AKRT023669	O=CCC(=O)O>>NCCC(=O)O	R00908