VAL
VALINE
Find entries where: VAL
is present as a standalone ligand in 48 entries
as a non-polymer is covalently linked to polymer or other heterogen groups 68 entries
is present in a polymer sequence 221,120 entries
Chemical Component Summary | |
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Name | VALINE |
Identifiers | (2S)-2-amino-3-methyl-butanoic acid |
Formula | C5 H11 N O2 |
Molecular Weight | 117.146 |
Type | L-PEPTIDE LINKING |
Isomeric SMILES | CC(C)[C@@H](C(=O)O)N |
InChI | InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1 |
InChIKey | KZSNJWFQEVHDMF-BYPYZUCNSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 19 |
Chiral Atom Count | 1 |
Bond Count | 18 |
Aromatic Bond Count | 0 |
Drug Info: DrugBank
DrugBank ID | DB00161 |
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Name | Valine |
Groups |
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Description | Valine is a branched-chain essential amino acid that has stimulant activity. It promotes muscle growth and tissue repair. It is a precursor in the penicillin biosynthetic pathway. |
Synonyms |
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Brand Names |
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Indication | Promotes mental vigor, muscle coordination, and calm emotions. May also be of use in a minority of patients with hepatic encephalopathy and in some with phenylketonuria. |
Categories |
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CAS number | 72-18-4 |
Drug Targets
Name | Target Sequence | Pharmacological Action | Actions |
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Propionyl-CoA carboxylase beta chain, mitochondrial | MAAALRVAAVGARLSVLASGLRAAVRSLCSQATSVNERIENKRRTALLGG... | unknown | |
Branched-chain-amino-acid aminotransferase, cytosolic | MKDCSNGCSAECTGEGGSKEVVGTFKAKDLIVTPATILKEKPDPNNLVFG... | unknown | |
Valine--tRNA ligase | MSTLYVSPHPDAFPSLRALIAARYGEAGEGPGWGGAHPRICLQPPPTSRT... | unknown | |
Valine--tRNA ligase | MSTLYVSPHPDAFPSLRALIAARYGEAGEGPGWGGAHPRICLQPPPTSRT... | unknown | substrate |
Propionyl-CoA carboxylase beta chain, mitochondrial | MAAALRVAAVGARLSVLASGLRAAVRSLCSQATSVNERIENKRRTALLGG... | unknown | substrate |
View More |
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison
T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS.
Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682
Related Resource References
Resource Name | Reference |
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PubChem | 88733505, 6287, 6971018 |
ChEMBL | CHEMBL43068 |
ChEBI | CHEBI:57762, CHEBI:16414 |
CCDC/CSD | FIYWIW, VALHCL12, ROKBOI02, LUDHAT, HOSMAE, WIHQUA, VALEHC11, OXEMEL, AHEJEC01, AHEJEC03, FACXUD, SONCED, VALHCL11, BANPOW, AHEJEC, BERPET, HOTXIY, VALIDL05, AHEJEC02, ABEHOF, NUZMIG, OPEFUL, UHEPIG, TUZJIJ, QURSUR, FITMEA, EWOZIZ, RUXWIQ, VALNIT01, HAGYEU, PAHCIL, GUQJUZ, DLVALC, ROKBOI, VALEHC10, OCOLID, MAZBOI, MAZBIC |
COD | 2203771, 2202036 |