Basic information
- CAS
119865-10-0- Standard SMILES
NC(N)=NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O- InChIKey
IYMAXBFPHPZYIK-BQBZGAKWSA-N- Molecular formula
- C12H22N6O6
- Average molar mass
- 346.34 g/mol
- Monoisotopic mass
- 346.16008244
Overview
Arg-Gly-Asp is a tripeptide.
Names & identifiers
- Preferred name
- Arginine-glycine-aspartic acid
- IUPAC
- (2S)-2-[[2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]butanedioic acid
- English name
- ARG-GLY-ASP
- Molecular formula
- C12H22N6O6
- Molecular weight
- 346.34
Names & synonyms
99896-85-2Arginyl-glycyl-aspartic acidRgd peptideRGD tripeptidearginine-glycine-aspartic acid78VO7F77PNDTXSID30912420(2S)-2-[[2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]butanedioic acid(2S)-2-((2-(((2S)-2-amino-5-(diaminomethylideneamino)pentanoyl)amino)acetyl)amino)butanedioic acidRefChem:916161DTXCID401341441Arg-gly-asp
Show more names
ARG-GLY-ASP PEPTIDEH2N-RGD-OHARG-GLY-ASL-ARG-GLY-ASPRGD (Arg-Gly-Asp)Arg-Gly-Asp (TLC)
Arginylglycylaspartic acidRGDL-Aspartic acid, L-arginylglycyl-Arginyl-glycyl-asparagilinH-Arg-Gly-Asp-OHF-336MFCD00057952L-arginylglycyl-L-aspartic acid
Database identifiers
- CAS
119865-10-0、124123-27-9、99896-85-2
Properties
Computed structural properties
- XLogP
- -6
- Topological polar surface area
- 223 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 504
Physicochemical properties
- Melting point
- 153 · 153-155℃ (ethyl ether )
- Density
- 1.61 · 1.61±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- solubility
- 0.1 N · Soluble in 0.1N acetic acid at 20mg/ml
- pka
- 2.85 · 2.85±0.10(Predicted)
- form
- Powder
- color
- White to off-white
- biological source
- synthetic
- Water Solubility
- 12 mg/mL · Soluble to 12 mg/mL (34.64 mM) in Water
- Sequence
- Arg-Gly-Asp
- InChI
- 1S/C12H22N6O6/c13-6(2-1-3-16-12(14)15)10(22)17-5-8(19)18-7(11(23)24)4-9(20)21/h6-7H,1-5,13H2,(H,17,22)(H,18,19)(H,20,21)(H,23,24)(H4,14,15,16)/t6-,7-/m0/s1
- InChIKey
- IYMAXBFPHPZYIK-BQBZGAKWSA-N
- SMILES
- C(O)(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)N
- FDA UNII
- 78 VO7F77PN · 78VO7F77PN
- UNSPSC Code
- 12352209 · 12352209
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302+H312+H332-H315-H319
- Precautionary statements
- P501-P261-P270-P271-P264-P280-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330-P302+P352+P312-P304+P340+P312
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationSubstances that inhibit or prevent the proliferation of NEOPLASMS.
Applications
UsesArg-Gly-Asp has been used:to saturate the cell surface Arg-Gly-Asp (RGD) receptors and inhibit marrow stromal cell (MSC) attachment to peptide modified hydrogelin adhesion assayin inhibition assay to confirm the β1-integrin-dependency of cell adhesionin textile fabrication and RGD textile functionalizationto engineer a population of human dermal fibroblasts with impaired migrationto modify glass substrate and evaluate the behavior of human bone marrow mesenchymal stem cells (hBM-MSCs)in the cell culture of human mammary epithelial cells
General DescriptionArg-Gly-Asp (RGD) is an integrin binding site, which belongs to the class of adhesive proteins. It functions as a brain tumor targeting ligand.
Additional notes
DefinitionChEBI: Arg-Gly-Asp is an oligopeptide.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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