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Aspartic acid; (±)-form

AlkaPlorer ID: AK289399

Synonym: None

IUPAC Name: 2-azaniumylbutanedioate

Structure

SMILES: [NH3+]C(CC(=O)[O-])C(=O)[O-]

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InChI: InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/p-1

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InChIKey: CKLJMWTZIZZHCS-UHFFFAOYSA-M

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Hordeum vulgare Hordeum Poaceae Poales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Morus alba Morus Moraceae Rosales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Cistanche deserticola Cistanche Orobanchaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Digenea simplex Digenea Rhodomelaceae Ceramiales Florideophyceae Rhodophyta None Eukaryota
Abrus precatorius Abrus Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Evolvulus alsinoides Evolvulus Convolvulaceae Solanales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Astragalus membranaceus Astragalus Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Beta vulgaris Beta Chenopodiaceae Caryophyllales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Homo sapiens Homo Hominidae Primates Mammalia Chordata Metazoa Eukaryota
Gossypium herbaceum Gossypium Malvaceae Malvales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Glycyrrhiza glabra Glycyrrhiza Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Saccharomyces cerevisiae Saccharomyces Saccharomycetaceae Saccharomycetales Saccharomycetes Ascomycota Fungi Eukaryota
Amaranthus caudatus Amaranthus Amaranthaceae Caryophyllales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Fagopyrum esculentum Fagopyrum Polygonaceae Caryophyllales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Ganoderma lucidum Ganoderma Polyporaceae Polyporales Agaricomycetes Basidiomycota Fungi Eukaryota
Lycium chinense Lycium Solanaceae Solanales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Justicia adhatoda Justicia Acanthaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 132.09499999999997

TPSA？: 107.9

MolLogP？: -4.513199999999999

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT001052 *[C@H](N)C(=O)O.NC(CC(=O)O)C(=O)O>>*C(NC(=O)C[C@H](N)C(=O)O)C(=O)O MNXR191776
AKRT002309 CC(=O)NC(CC(=O)O)C(=O)O>>NC(CC(=O)O)C(=O)O enzymemap_76667
AKRT011425 COc1cc(/C=C/C(=O)NC(CC(=O)O)C(=O)O)ccc1O>>NC(CC(=O)O)C(=O)O enzymemap_77818
AKRT016793 NC(=O)CC(N)C(=O)O>>NC(CC(=O)O)C(=O)O MNXR192403
AKRT017026 NC(=O)NC(CC(=O)O)C(=O)O>>NC(CC(=O)O)C(=O)O enzymemap_78014
AKRT017145 NC(=O)OP(=O)(O)O.NC(CC(=O)O)C(=O)O>>NC(=O)N[C@@H](CC(=O)O)C(=O)O MNXR192559
AKRT017350 NC(CC(=O)O)C(=O)NO>>NC(CC(=O)O)C(=O)O enzymemap_75974
AKRT017351 NC(CC(=O)O)C(=O)O.O=C(O)CCC(=O)C(=O)O>>N[C@@H](CCC(=O)O)C(=O)O MNXR192557
AKRT017352 NC(CC(=O)O)C(=O)O.O=c1[nH]cnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O>>O=C(O)C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O)C(=O)O MNXR192667
AKRT017353 NC(CC(=O)O)C(=O)O>>N=C(CC(=O)O)C(=O)O enzymemap_22024
AKRT020502 Nc1c(C(=O)N[C@@H](CC(=O)O)C(=O)O)ncn1[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O>>NC(CC(=O)O)C(=O)O MNXR192577
AKRT022684 O=C(O)CC(=O)C(=O)O>>NC(CC(=O)O)C(=O)O enzymemap_42004
AKRT022719 O=C(O)CC(NC(=O)CCl)C(=O)O>>NC(CC(=O)O)C(=O)O enzymemap_76630