Account Chelocardin
- Catalog No. :
- ACYMLB121
- CAS No. :
- 29144-42-1
- Molecular Formula :
- C22H21NO7
- Molecular Weight :
- 411.41
IUPAC Name:(4R,4aS,12aS)-2-acetyl-4-amino-3,10,11,12a-tetrahydroxy-6,9-dimethyl-4a,12a-dihydrotetracene-1,12(4H,5H)-dione
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Product Information
| Product Name | Chelocardin |
|---|---|
| IUPAC Name | (4R,4aS,12aS)-2-acetyl-4-amino-3,10,11,12a-tetrahydroxy-6,9-dimethyl-4a,12a-dihydrotetracene-1,12(4H,5H)-dione |
| Molecular Formula | C22H21NO7 |
| Molecular Weight | 411.41 |
| SMILES | CC(=O)C1=C(O)[C@H](N)[C@@H]2CC3=C(C(=O)[C@]2(O)C1=O)C(O)=C1C(O)=C(C)C=CC1=C3C |
| InChI Key | IRCLZBUBOWPFCH-ONJZCGHCSA-N |
| Synonym | 1,12-(4H,5H)-Naphthacenedione, 2-acetyl-4-alpha-amino-4a-beta,12a-dihydro- 3,10,11,12a-beta-tetrahydroxy-6,9-dimethyl- | DTXSID50951750 | rel-(4R,4aS,12aS)-2-Acetyl-4-amino-4a,12a-dihydro-3,10,11,12a-tetrahydroxy-6,9-dimethyl-1,12(4H,5H)-naphthacenedione |
| CAS No. | 29144-42-1 |
| PubChem CID | 71402 |
Synthetic Route by SureRoute
2. ACYMLB121 Molecular Building Block Synthetic Route
Cetocycline hydrochloride
Rel-(4S,4aS,12aS)-4,7-bis(dimethylamino)-3,10,11,12a-tetrahydroxy-1,12-dioxo-1,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide
(4R,4aS,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-3,4,4a,5,12,12a-hexahydrotetracene-2-carboxamide hydrochloride