2D structurePubChem CID 4086
Ταυτότητα
Orciprenaline
CAS 586-06-1 · C11H17NO3
01Ταυτότητα
| Lazychem ID | LC-101195 |
|---|---|
| CAS RN | 586-06-1 |
| PubChem CID | 4086 |
| Molecular formula | C11H17NO3 |
| Molecular weight | 211.26 g/mol |
| IUPAC name | 5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,3-diol |
| InChIKey | LMOINURANNBYCM-UHFFFAOYSA-N |
02Δομή και στερεοχημεία
2D structurePubChem CID 4086
The parsed structure contains 1 ring, includes aromatic atoms, includes aliphatic carbon. These statements are calculated from the published structure string.
| Defined stereocentres | 0 |
|---|---|
| Ring count | 1 |
| Secondary amines | 1 |
| Tertiary amines | 0 |
| SMILES | CC(C)NCC(C1=CC(=CC(=C1)O)O)O |
|---|---|
| InChI | Δεν αναφέρεται |
03Stereochemistry
The published structure contains 0 defined and 1 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.
Defined centres0Structure assigned
Unassigned centres1Structure unspecified
Assignment statusUnassignedExact published identity
Tetrahedral upper bound≤ 2Before 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.
04Κατάσταση στην Ινδία
Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.
05Ονόματα και σχέσεις
API και μητρικό φάρμακο
Δεν αναφέρεται
Ονόματα και σχέσεις
- ORCIPRENALINE
- metaproterenol
- 586-06-1
- Orciprenalina
- Orciprenalinum
- (RS)-1-(3,5-Dihydroxyphenyl)-2-isopropylaminoethanol
- 5-{1-hydroxy-2-[(propan-2-yl)amino]ethyl}benzene-1,3-diol
- 53QOG569E0
- 3,5-Dihydroxy-alpha-((isopropylamino)methyl)benzyl alcohol
- NSC-757089
- CHEBI:6792
- DTXSID8048529
06Πηγές
- S01PubChem CID 4086
Structure and machine-readable chemical identifiers.