Account Ladirubicin
- Catalog No. :
- ACMFMD330
- CAS No. :
- 171047-47-5
- Molecular Formula :
- C29H31NO11S
- Molecular Weight :
- 601.63
IUPAC Name:(2S,3S,4S,6R)-6-(((1S,3S)-3-acetyl-3,5,12-trihydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl)oxy)-4-(aziridin-1-yl)-2-methyltetrahydro-2H-pyran-3-yl methanesulfonate
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Product Information
| Product Name | Ladirubicin |
|---|---|
| IUPAC Name | (2S,3S,4S,6R)-6-(((1S,3S)-3-acetyl-3,5,12-trihydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl)oxy)-4-(aziridin-1-yl)-2-methyltetrahydro-2H-pyran-3-yl methanesulfonate |
| Molecular Formula | C29H31NO11S |
| Molecular Weight | 601.63 |
| SMILES | CS(=O)(O[C@@H]1[C@H](C)O[C@@H](O[C@H]2C[C@](O)(C(C)=O)CC3=C(O)C4=C(C(C5=CC=CC=C5C4=O)=O)C(O)=C23)C[C@@H]1N6CC6)=O |
| InChI Key | VMDWTZZCNDEKIO-CBNJBKGYSA-N |
| Synonym | (7S,9S)-9-acetyl-7-[(2S,4S,5S,6S)-4-aziridin-1-yl-6-methyl-5-methylsulfonyloxy-oxan-2-yl]oxy-6,9,11-trihydroxy-8,10-dihydro-7H-tetracene-5,12-dione;5,12-Naphthacenedione, 9-acetyl-7-[[3-(1-aziridinyl)-2,3,6-trideoxy-4-O-(methylsulfonyl)-α-L-lyxo-hexopyranosyl]oxy]-7,8,9,10-tetrahydro-6,9,11-trihydroxy-, (7S,9S)-;Ladirubicin |
| CAS No. | 171047-47-5 |
Synthetic Route by SureRoute
2. ACMFMD330 Molecular Building Block Synthetic Route
N,N-Dimethyldoxorubicin
(7S,9S)-9-acetyl-7-(((2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-6,9,11-trihydroxy-7,8,9,10-tetrahydrotetracene-5,12-dione hydrochloride
(7S,9S)-9-Acetyl-7-(((2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-6,9,11-trihydroxy-7,8,9,10-tetrahydrotetracene-5,12-dione