2D structurePubChem CID 64715
Identidade
Mevastatin
Não indicado · C23H34O5
01Identidade
| Lazychem ID | LC-53408 |
|---|---|
| CAS RN | Não indicado |
| PubChem CID | 64715 |
| Molecular formula | C23H34O5 |
| Molecular weight | 390.5 g/mol |
| IUPAC name | [(1S,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-7-methyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate |
| InChIKey | AJLFOPYRIVGYMJ-INTXDZFKSA-N |
02Estrutura e estereoquímica
2D structurePubChem CID 64715
The parsed structure contains 3 rings, includes aliphatic carbon, has 7 defined stereocentres. These statements are calculated from the published structure string.
| Defined stereocentres | 7 |
|---|---|
| Ring count | 3 |
| Secondary amines | 0 |
| Tertiary amines | 0 |
| SMILES | CC[C@H](C)C(=O)O[C@H]1CCC=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3C[C@H](CC(=O)O3)O |
|---|---|
| InChI | Não indicado |
03Stereochemistry
The published structure contains 7 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.
Defined centres7Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 128Before 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 2854
Lovastatin EP Impurity A/ Pravastatin Deshydroxy Impurity/ Mevastatin/ Compactin
CAS 73573-88-3
AJLFOPYRIVGYMJ-UHFFFAOYSA-N
0 defined, 7 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 na Índia
Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.
05Nomes e relações
API e fármaco de origem
Não indicado
Nomes e relações
06Fontes
- S01PubChem CID 64715
Structure and machine-readable chemical identifiers.