2D structurePubChem CID 104501
Identiteta
Anhydroxylitol
Ni navedeno · C5H10O4
01Identiteta
| Lazychem ID | LC-116505 |
|---|---|
| CAS RN | Ni navedeno |
| PubChem CID | 104501 |
| Molecular formula | C5H10O4 |
| Molecular weight | 134.13 g/mol |
| IUPAC name | (2R,3R,4S)-2-(hydroxymethyl)oxolane-3,4-diol |
| InChIKey | KZVAAIRBJJYZOW-VPENINKCSA-N |
02Struktura in stereokemija
2D structurePubChem CID 104501
The parsed structure contains 1 ring, includes aliphatic carbon, has 3 defined stereocentres. These statements are calculated from the published structure string.
| Defined stereocentres | 3 |
|---|---|
| Ring count | 1 |
| Secondary amines | 0 |
| Tertiary amines | 0 |
| SMILES | C1[C@@H]([C@H]([C@H](O1)CO)O)O |
|---|---|
| InChI | Ni navedeno |
03Stereochemistry
The published structure contains 3 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.
Defined centres3Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 8Before symmetry reduction
Published same-connectivity configurations
1 recordThese records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.
No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.
Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.
04Status v Indiji
Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.
05Imena in povezave
API in matično zdravilo
Ni navedeno
Imena in povezave
06Viri
- S01PubChem CID 104501
Structure and machine-readable chemical identifiers.