D-Glucosamine | SBID = 374 | Compound |
Structure
Molecular Properties
| Interactions: | 2 | ||
| PubChem TPSA/Å2: | 116.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -2.8 | ||
| 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): | 5.0 | ||
| 3D Volume/Å3: | 124.1 | ||
| Sum Formula: | C6H13NO5 | ||
| M / g/mol: | 179.172 | ||
| Complexity: | 155.0 | ||
| Number of Conformers: | 7.0 |
Identifiers
- Tags: typical guest
- Name: D-Glucosamine
- Preferred Abbreviation: D-Glucosamine
- IUPAC Name: (3R,4R,5S,6R)-3-amino-6-(hydroxymethyl)oxane-2,4,5-triol
- CAS: 3416-24-8
- CID: 439213
- InChiKey: MSWZFWKMSRAUBD-IVMDWMLBSA-N
- InChi: InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4-,5-,6?/m1/s1
- CanoSmiles: C(C1C(C(C(C(O1)O)N)O)O)O
- IsoSmiles: C([C@@H]1[C@H]([C@@H]([C@H](C(O1)O)N)O)O)O
