Arginylarginine | SBID = 1363 | Compound |
Structure
Molecular Properties
| Interactions: | 2 | ||
| PubChem TPSA/Å2: | 221.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -6.5 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 7.0 | ||
| Number of H-Bond Acceptors: | 6.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 2.0 | ||
| 3D Volume/Å3: | 247.0 | ||
| Sum Formula: | C12H26N8O3 | ||
| M / g/mol: | 330.39 | ||
| Complexity: | 444.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags: typical guest, amino acid
- Name: Arginylarginine
- Preferred Abbreviation: Arg-arg
- IUPAC Name: (2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
- CAS: 15483-27-9
- CID: 151956
- InChiKey: OMLWNBVRVJYMBQ-YUMQZZPRSA-N
- InChi: InChI=1S/C12H26N8O3/c13-7(3-1-5-18-11(14)15)9(21)20-8(10(22)23)4-2-6-19-12(16)17/h7-8H,1-6,13H2,(H,20,21)(H,22,23)(H4,14,15,18)(H4,16,17,19)/t7-,8-/m0/s1
- CanoSmiles: C(CC(C(=O)NC(CCCN=C(N)N)C(=O)O)N)CN=C(N)N
- IsoSmiles: C(C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)N)CN=C(N)N
