AC1L4S4N
4-amino-7-[(6R,7R)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide
Also Known As: Sangivamycin 3',5'-cyclic phosphate|4-amino-7-[(6r,7r)-2,7-dihydroxy-2-oxidotetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-7h-pyrrolo[2,3-d]pyrimidine-5-carboxamide|4-amino-7-[(6R,7R)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide|4-Amino-7-(2,7-dihydroxy-2-oxotetrahydro-2H,4H-2lambda~5~-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl)-7H-pyrrolo[2,3-d]pyrimidine-5-carboximidic acid|4-Amino-7-[(6R,7R)-2,7-dihydroxy-2-oxotetrahydro-2H,4H-2lambda~5~-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-7H-pyrrolo[2,3-d]pyrimidine-5-carboximidic acid
| Molecular Formula | C12H14N5O7P |
|---|---|
| Molecular Weight | 371.06308 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 185.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 371.06308 |
| Monoisotopic Mass | 371.06308 |
| Heavy Atoms | 25 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 5472-25-3 |
|---|---|
| SMILES | C1C2C([C@H]([C@@H](O2)N3C=C(C4=C(N=CN=C43)N)C(=O)N)O)OP(=O)(O1)O |
| InChIKey | DUNLVHIDDNNAQP-GGSWABCNSA-N |
Product Overview
AC1L4S4N (CAS 5472-25-3), with molecular formula C12H14N5O7P and molecular weight 371.06308 g/mol. IUPAC: 4-amino-7-[(6R,7R)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide.
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