2D structurePubChem CID 6167
Identidad
Colchicin
CAS 64-86-8 · C22H25NO6
01Identidad
| Lazychem ID | LC-100865 |
|---|---|
| CAS RN | 64-86-8 |
| PubChem CID | 6167 |
| Molecular formula | C22H25NO6 |
| Molecular weight | 399.4 g/mol |
| IUPAC name | N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide |
| InChIKey | IAKHMKGGTNLKSZ-INIZCTEOSA-N |
02Estructura y estereoquímica
2D structurePubChem CID 6167
The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon, has 1 defined stereocentre. These statements are calculated from the published structure string.
| Defined stereocentres | 1 |
|---|---|
| Ring count | 3 |
| Secondary amines | 0 |
| Tertiary amines | 0 |
| SMILES | CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC |
|---|---|
| InChI | No indicado |
03Stereochemistry
The published structure contains 1 defined and 0 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.
Defined centres1Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction
Published same-connectivity configurations
2 recordsThese records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.
2D structurePubChem CID 2833
Thiocolchicoside EP Impurity A/Colchicine
CAS 64-86-8
IAKHMKGGTNLKSZ-UHFFFAOYSA-N
0 defined, 1 unassigned centres
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.
04Estado en India
Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.
05Nombres y relaciones
API y fármaco de origen
No indicado
Nombres y relaciones
- colchicine
- 64-86-8
- Colchisol
- Colchineos
- Colchicinum
- Colchicina
- Colcrys
- Mitigare
- 7-alpha-H-Colchicine
- DTXSID5024845
- NSC 757
- LODOCO
06Fuentes
- S01PubChem CID 6167
Structure and machine-readable chemical identifiers.