Glycoside
GD040183
Name:
thymidine-5'-diphospho-beta-d-xyloseFormula:
C15H24O15N2P2Smiles:
Cc1cn([C@@H]2C[C@@H](O)[C@@H](CO[P@](=O)(O)O[P@](=O)(O)O[C@H]3OC[C@H](O)[C@H](O)[C@@H]3O)O2)c(=O)[nH]c1=OAglycone:
Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.73 |
| AlogP: | -2.82 | Num_rotatable_bonds: | 8 |
| MolWt: | 534.3 | Num_heavy_atoms: | 34 |
| TPSA: | 256.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD16349
Formula: C10H16O11N2P2
Smiles:
Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O| HBA: | 13 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 6 |
| MolWt: | 402.19 | Num_heavy_atoms: | 25 |
| TPSA: | 197.61 | NumAromaticRings: | 1 |
