Gly-tyr-gly | SBID = 1229 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 142.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -3.4 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 5.0 | ||
| Number of H-Bond Acceptors: | 6.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 1.0 | ||
| 3D Volume/Å3: | 222.2 | ||
| Sum Formula: | C13H17N3O5 | ||
| M / g/mol: | 295.29 | ||
| Complexity: | 380.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags: peptide
- Name: Gly-tyr-gly
- Preferred Abbreviation: Gly-tyr-gly
- IUPAC Name: 2-[[2-[(2-aminoacetyl)amino]-3-(4-hydroxyphenyl)propanoyl]amino]acetic acid
- CAS: 6099-08-7
- CID: 100083
- InChiKey: HQSKKSLNLSTONK-UHFFFAOYSA-N
- InChi: InChI=1S/C13H17N3O5/c14-6-11(18)16-10(13(21)15-7-12(19)20)5-8-1-3-9(17)4-2-8/h1-4,10,17H,5-7,14H2,(H,15,21)(H,16,18)(H,19,20)
- CanoSmiles: C1=CC(=CC=C1CC(C(=O)NCC(=O)O)NC(=O)CN)O
- IsoSmiles: C1=CC(=CC=C1CC(C(=O)NCC(=O)O)NC(=O)CN)O
