Compound: L-valine
SMILES: O=C(O)[C@@H](N)C(C)C
InChIKey: KZSNJWFQEVHDMF-BYPYZUCNSA-N
Synonyms: L-valine, valine, 72-18-4, (S)-Valine, (S)-2-Amino-3-methylbutanoic acid, (2S)-2-amino-3-methylbutanoic acid, 2-Amino-3-methylbutyric acid, (S)-2-Amino-3-methylbutyric acid, valina, L-alpha-Amino-beta-methylbutyric acid, L-valin, Valinum, (S)-alpha-Amino-beta-methylbutyric acid, NSC-76038, l-(+)-alpha-Aminoisovaleric acid, HG18B9YRS7, CHEBI:16414, DTXSID40883233, L-Val, 2-amino-3-methylbutanoate, (2S)-2-amino-3-methylbutanoate, l valine, CHEBI:27266, L-Valine High, RefChem:6509, L-Valine 7429, L-Valine High 7430, DTXCID201022782, (2S)-2-amino-3-methylbutanoate;hydron, 200-773-6, (2S)-2-azaniumyl-3-methylbutanoate, H-Val-OH, 7004-03-7, Valinum [Latin], Valina [Spanish], Butanoic acid, 2-amino-3-methyl-, Valine (VAN), Valine [USAN:INN], VALINE, L-, L(+)-alpha-Aminoisovaleric acid, Butanoic acid, 2-amino-3-methyl-, (S)-, MFCD00064220, 2-Amino-3-methylbutyric acid, (S)-, 2-Amino-3-methylbutanoic acid, (S)-, val, NSC 76038, (L)-valine, Valine (L-Valine), L-2-Amino-3-methylbutanoic acid, L-2-Aminoisovaleric Acid, M02950, 2-aminoisovaleric acid, (+)-valine, alpha-aminoisovaleric acid, EINECS 200-773-6, (S)-alpha-Aminoisovaleric acid, UNII-HG18B9YRS7, Racemic valine, L-(+)-a-Aminoisovaleric acid, s-valin, L-(+)-.alpha.-Aminoisovaleric acid, L-a-Amino-b-methylbutyric acid, HSDB 7800, 3h-l-valine, Valine CRS, (S)-a-Amino-b-methylbutyric acid, L-Valine, FCC, Valine (USP), 1t4s, L-Valine (JP18), L-Valine, 99%, VALINE [VANDF], Threonine EP Impurity C, VALINE [HSDB], VALINE [USAN], (S)-Val, L-Val-4, L-VAL-OH, VALINE [INN], VALINE [WHO-DD], VALINE [II], VALINE [MI], 2-Amino-3-methylbutyrate, L-VALINE [FCC], L-VALINE [JAN], VALINE [MART.], bmse000052, bmse000811, bmse000860, EC 200-773-6, L-(+)-a-Aminoisovalerate, L-a-Amino-b-methylbutyrate, SCHEMBL8516, (S)-A-Aminoisovaleric acid, L-VALINE [USP-RS], CHEMBL43068, VALINE [EP MONOGRAPH], (S)-a-Amino-b-methylbutyrate, L-(+)-alpha-Aminoisovalerate, L-iso-C3H7CH(NH2)COOH, VALINE [USP MONOGRAPH], GTPL4794, orb1304730, SCHEMBL3482794, SCHEMBL6486880, SCHEMBL6954847, (S)-2-Amino-3-methylbutyrate, (S)-2-Amino-3-methylbutanoate, L-alpha-Amino-beta-methylbutyrate, MSK1420, (S)-2-amino-3-methyl-Butanoate, Pharmakon1600-01301009, HY-N0717, (S)-alpha-Amino-beta-methylbutyrate, (S)-2-amino-3-methyl-butyric acid, BDBM50463208, EBC-03948, NSC760111, s5628, (S)-2-amino-3-methyl-Butanoic acid, L-Valine, 98.5-101.5%, AKOS015841564, CCG-266067, CS-W020706, DB00161, FV00534, L-Valine, 99%, natural, FCC, FG, NSC-760111, RP10200, NCGC00344520-01, AS-12787, L-Valine, BioUltra, >=99.5% (NT), SY002589, L-Valine, SAJ special grade, >=98.5%, DB-029989, DB-234161, L-Valine, reagent grade, >=98% (HPLC), V0014, EN300-52625, C00183, D00039, L-Valine, Cell Culture Reagent (H-L-Val-OH), LYSINE ACETATE IMPURITY D [EP IMPURITY], SBI-0633454.0002, (S)-(+)-2-AMINO-3-METHYLBUTYRIC ACID, Q483752, Q-100919, L-Valine, certified reference material, TraceCERT(R), L-Valine, meets the analytical specifications of USP, Valine Working Standard (Secondary Reference Standard), F8889-8698, Valine, European Pharmacopoeia (EP) Reference Standard, Z756430564, 1B39571B-0AE8-4A9A-AE80-4B898D11A981, L-Valine, United States Pharmacopeia (USP) Reference Standard, (S)-alpha-Aminoisovaleric acid, (L)-2-Amino-3-methylbutanoic acid, L-Valine, Pharmaceutical Secondary Standard; Certified Reference Material, InChI=1/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s, L-Valine, from non-animal source, meets EP, JP, USP testing specifications, suitable for cell culture, 98.5-101.0%
Theoretical properties:
molecular_formula: C5H11NO2
molecular_weight: 117.15 g/mol
exact_mass: 117.078978594 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 2
hydrogen_bond_acceptor_count: 3
rotatable_bond_count: 2
heavy_atom_count: 8
topological_polar_surface_area: 63.3 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: Leaflets from water + alcohol
color: Leaflets from water + alcohol
boiling_point: Sublimes
density: 1.23 g/cu cm at 25 °C
vapor_pressure: 0.00000003 [mmHg]
Descriptions:
pubchem: L-valine is the L-enantiomer of valine. It has a role as a micronutrient, a nutraceutical, a mouse metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite, a human metabolite and an algal metabolite. It is a L-alpha-amino acid, a pyruvate family amino acid, a valine and a proteinogenic amino acid. It is a conjugate base of a L-valinium. It is a conjugate acid of a L-valinate. It is an enantiomer of a D-valine. It is a tautomer of a L-valine zwitterion.
chebi: The <small>L</small>-enantiomer of valine.
chembl: VALINE is a small molecule listed in the ChEMBL database and has reached clinical trial phase 2.0.
wikipedia: Valine (symbol Val or V) is an α-amino acid that is used in the biosynthesis of proteins. It contains an α-amino group (which is in the protonated −NH3+ form under biological conditions), an α-carboxylic acid group (which is in the deprotonated −COO− form under biological conditions), and a side chain isopropyl group, making it a non-polar aliphatic amino acid. Valine is essential in humans, meaning the body cannot synthesize it; it must be obtained from dietary sources which are foods that contain proteins, such as meats, dairy products, soy products, beans and legumes. It is encoded by all codons starting with GU (GUU, GUC, GUA, and GUG).