Basic information
- CAS
41017-96-3- Standard SMILES
CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)O)C(C)C- InChIKey
BCXBIONYYJCSDF-CIUDSAMLSA-N- Molecular formula
- C11H22N2O3
- Average molar mass
- 230.3 g/mol
- Monoisotopic mass
- 230.16304257
Overview
Ile-Val is a dipeptide formed from L-isoleucine and L-valine residues. It has a role as a metabolite.
Names & identifiers
- Preferred name
- Ile-Val
- IUPAC
- (2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-methylbutanoic acid
- English name
- H-Ile-Val-OH
- Molecular formula
- C11H22N2O3
- Molecular weight
- 230.3
Names & synonyms
L-isoleucyl-L-valine41017-96-3IsoleucylvalineIle-valIsoleucyl-ValineL-Valine, N-L-isoleucyl-CHEBI:74327(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-methylbutanoic acidIV dipeptideI-V DipeptideIsoleucine Valine dipeptideIsoleucine-Valine dipeptide
Show more names
L-Valine, L-isoleucyl-(S)-2-((2S,3S)-2-amino-3-methylpentanamido)-3-methylbutanoic acid
2-((2-Amino-1-hydroxy-3-methylpentylidene)amino)-3-methylbutanoate2-[(2-Amino-1-hydroxy-3-methylpentylidene)amino]-3-methylbutanoate(2S)-2-(((2S,3S)-2-amino-3-methylpentanoyl)amino)-3-methylbutanoic acid(2S)-2-(((2S,3S)-2-azaniumyl-3-methylpentanoyl)amino)-3-methylbutanoate(2S)-2-[[(2S,3S)-2-azaniumyl-3-methylpentanoyl]amino]-3-methylbutanoateRefChem:147827BCXBIONYYJCSDF-UHFFFAOYSA-NH-ILE-VAL-OH
Database identifiers
- CAS
41017-96-3- PubChem CID
- 449407
- DTXSID
DTXSID20961386- ChEMBL
CHEMBL293266
Properties
Computed structural properties
- XLogP
- -2.2
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 254
Physicochemical properties
- Boiling point
- 421.9 · 421.9±30.0 °C(Predicted)
- Density
- 1.221 g/cm3 · 1.221 g/cm3(Temp: 26 °C)
- storage temp.
- -15 °C · -15°C
- pka
- 3.18 · 3.18±0.10(Predicted)
Chemistry & industry
Applications
UsesL-Isoleucyl-L-valine (Ile-Val) is a dipeptide that induces the bovine trypsinogen-trypsin transition[1].
Suppliers32 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
上海鸿肽生物科技有限公司15318089928 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
杭州思诺达医药科技有限责任公司0571-87213919 17306812703 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
常州希辰曦生物科技有限公司13961235446 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
NANJING YINGWEN BIOTECHNOLOGY CO LTD+8613382787392 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
太原百利恒康生物技术有限公司19135651983 · [email protected]
康明永瑞生物科技（苏州）有限公司17751201929; 17751201929 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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