Account Tiamulin fumarate
- Catalog No. :
- ACVMHV284
- CAS No. :
- 55297-96-6
- Molecular Formula :
- C32H51NO8S
- Molecular Weight :
- 609.83
IUPAC Name:(3aS,5R,7S,8S,9R,12R)-8-hydroxy-4,7,9,12-tetramethyl-3-oxo-7-vinyldecahydro-4,9a-propanocyclopenta[8]annulen-5-yl 2-((2-(diethylamino)ethyl)thio)acetate fumarate
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Product Information
| Product Name | Tiamulin fumarate |
|---|---|
| IUPAC Name | (3aS,5R,7S,8S,9R,12R)-8-hydroxy-4,7,9,12-tetramethyl-3-oxo-7-vinyldecahydro-4,9a-propanocyclopenta[8]annulen-5-yl 2-((2-(diethylamino)ethyl)thio)acetate fumarate |
| MDL No. | MFCD00145407 |
| Molecular Formula | C32H51NO8S |
| Molecular Weight | 609.83 |
| SMILES | C=C[C@]1(C)C[C@@H](OC(=O)CSCCN(CC)CC)C2(C)[C@H](C)CCC3(CCC(=O)[C@@H]32)[C@@H](C)[C@@H]1O.O=C(O)/C=C/C(=O)O |
| InChI Key | YXQXDXAHCSEVSD-LKNSULBJSA-N |
| Synonym | Acetic acid, ((2-(diethylamino)ethyl)thio)-, 6-ethenyldecahydro-5-hydroxy-4,6,9,10-tetramethyl-1-oxo-3a,9-propano-3aH-cyclopentacycloocten-8-yl ester (3aS-(3aalpha,4beta,5alpha,6alpha,8beta,9alpha,9abeta,10S*))-, (E)-2-butenedioate (1:1) (salt) | Acetic a |
| CAS No. | 55297-96-6 |
| PubChem CID | 23725049 |
Synthetic Route by SureRoute
2. ACVMHV284 Molecular Building Block Synthetic Route
(3aR,5R,7S,8S,9R,12R)-8-hydroxy-4,7,9,12-tetramethyl-3-oxo-7-vinyldecahydro-4,9a-propanocyclopenta[8]annulen-5-yl 2-hydroxyacetate
5-hydroxy-4,6,9,10-tetramethyl-1-oxo-6-vinyldecahydro-3a,9-propanocyclopenta[8]annulen-8-yl 2-((1-(2-amino-3-methylbutanamido)-2-methylpropan-2-yl)thio)acetate hydrochloride
(3aR,4R,5R,7S,8S,9R,9aS,12R)-8-Hydroxy-4,7,9,12-tetramethyl-3-oxo-7-vinyldecahydro-4,9a-propanocyclopenta[8]annulen-5-yl 2-(((1R,2R,4R)-4-amino-2-hydroxycyclohexyl)thio)acetate acetate