Spermine (fully protonated form) | SBID = 508 | Compound |
Structure
Molecular Properties
| Interactions: | 16 | ||
| PubChem TPSA/Å2: | 88.5 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -1.1 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 4.0 | ||
| Number of H-Bond Donors: | 4.0 | ||
| Number of H-Bond Acceptors: | 0.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | 170.4 | ||
| Sum Formula: | C10H30N4+4 | ||
| M / g/mol: | 206.37 | ||
| Complexity: | 86.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags: cation, typical guest, charged
- Name: Spermine (fully protonated form)
- Preferred Abbreviation: Spermine (fully protonated form)
- IUPAC Name: 3-azaniumylpropyl-[4-(3-azaniumylpropylazaniumyl)butyl]azanium
- CAS:
- CID: 446718
- InChiKey: PFNFFQXMRSDOHW-UHFFFAOYSA-R
- InChi: InChI=1S/C10H26N4/c11-5-3-9-13-7-1-2-8-14-10-4-6-12/h13-14H,1-12H2/p+4
- CanoSmiles: C(CC[NH2+]CCC[NH3+])C[NH2+]CCC[NH3+]
- IsoSmiles: C(CC[NH2+]CCC[NH3+])C[NH2+]CCC[NH3+]
