Account N-(Iodoacetamido)-Doxorubicin
- Catalog No. :
- ACXTSH740
- CAS No. :
- 114390-30-6
- Molecular Formula :
- C29H30INO12
- Molecular Weight :
- 711.46
IUPAC Name:N-((2S,3S,4S,6R)-3-hydroxy-2-methyl-6-(((1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl)oxy)tetrahydro-2H-pyran-4-yl)-2-iodoacetamide
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Product Information
| Product Name | N-(Iodoacetamido)-Doxorubicin |
|---|---|
| IUPAC Name | N-((2S,3S,4S,6R)-3-hydroxy-2-methyl-6-(((1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl)oxy)tetrahydro-2H-pyran-4-yl)-2-iodoacetamide |
| Molecular Formula | C29H30INO12 |
| Molecular Weight | 711.46 |
| SMILES | OC=1C2=C([C@@H](O[C@H]3C[C@H](NC(CI)=O)[C@H](O)[C@H](C)O3)C[C@@](C(CO)=O)(O)C2)C(O)=C4C1C(=O)C=5C(C4=O)=C(OC)C=CC5 |
| InChI Key | SAGBOHNSGVDWII-MUTSDZRXSA-N |
| Synonym | N-(Iodoacetamido)-Doxorubicin;5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-10-[[2,3,6-trideoxy-3-[(iodoacetyl)amino]-α-L-lyxo-hexopyranosyl]oxy]-, (8S,10S)- (9CI);5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-10-[[2,3,6-trideoxy-3-[(iodoacetyl)amino]-α-L-lyxo-hexopyranosyl]oxy]-, (8S,10S)- |
| CAS No. | 114390-30-6 |
Synthetic Route by SureRoute
2. ACXTSH740 Molecular Building Block Synthetic Route
N,N-Dimethyldoxorubicin
Leurubicin
(8S,10S)-10-(((2R,4S,5R,6S)-4-Amino-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-6,8,11-trihydroxy-8-(2-hydroxyacetyl)-1-methoxy-7,8,9,10-tetrahydrotetracene-5,12-dione hydrochloride