HF4
4-amino-1-{5-O-[(S)-hydroxy{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-beta-D-arabinofuranosyl}pyrimidin-2(1H)-one
Find entries where: HF4
is present as a standalone ligand in 3 entries
Chemical Component Summary | |
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Name | 4-amino-1-{5-O-[(S)-hydroxy{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-beta-D-arabinofuranosyl}pyrimidin-2(1H)-one |
Synonyms | Cytarabine-TRIPHOSPHATE |
Identifiers | [[(2~{R},3~{S},4~{S},5~{R})-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate |
Formula | C9 H16 N3 O14 P3 |
Molecular Weight | 483.156 |
Type | NON-POLYMER |
Isomeric SMILES | C1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O |
InChI | InChI=1S/C9H16N3O14P3/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H2,10,11,15)(H2,16,17,18)/t4-,6-,7+,8-/m1/s1 |
InChIKey | PCDQPRRSZKQHHS-CCXZUQQUSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 45 |
Chiral Atom Count | 4 |
Bond Count | 46 |
Aromatic Bond Count | 0 |
Related Resource References
Resource Name | Reference |
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PubChem | 25774 |
ChEMBL | CHEMBL3417290 |