2-[[2-[[2-Amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
Basic information
- CAS
7390-78-5- Standard SMILES
NC(Cc1ccc(O)cc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)O- InChIKey
RMRFSFXLFWWAJZ-UHFFFAOYSA-N- Molecular formula
- C27H29N3O7
- Average molar mass
- 507.5 g/mol
- Monoisotopic mass
- 507.20055027
Names & identifiers
- Preferred name
- 2-[[2-[[2-Amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
- IUPAC
- 2-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid
- English name
- H-TYR-TYR-TYR-OH
- Molecular formula
- C27H29N3O7
- Molecular weight
- 507.54
Names & synonyms
2-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoic acidTyr-Tyr-Tyr-OHTyrosyltyrosyltyrosineSCHEMBL10789173TYR-TYR-TYRL-TYR-TYR-TYRTripeptide YYYH-TYR-TYR-TYR-OHREF DUPL: H-Tyr-Tyr-Tyr-OHH-Tyr-Tyr-Tyr-OH (H-5230.0050)L-Tyrosyl-L-tyrosyl-L-tyrosineL-Tyrosine, L-tyrosyl-L-tyrosyl-
Show more names
(S)-2-((S)-2-((S)-2-amino-3-(4-hydroxyphenyl)propanamido)-3-(4-hydroxyphenyl)propanamido)-3-(4-hydroxyphenyl)propanoic acid
Database identifiers
- CAS
7390-78-5- PubChem CID
- 4606266
- DTXSID
DTXSID00404802
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 182 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 742
Physicochemical properties
- Boiling point
- 940.6 · 940.6±65.0 °C(Predicted)
- Density
- 1.387 · 1.387±0.06 g/cm3(Predicted)
- storage temp.
- 20 °C · −20°C
- pka
- 3.07 · 3.07±0.10(Predicted)
- WGK Germany
- 3 · 3
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
- wgk
- 3
Chemistry & industry
Additional notes
DefinitionChEBI: Tyr-Tyr-Tyr is an oligopeptide.
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…