Glycoside
GD157767
Name:
3'-O-[Beta-D-Galactopyranosyl-(1-->4)-Beta-D-Galactopyranosyl]-5-BromouridineFormula:
C21H31O16N2BrSmiles:
O=c1nc(O)c(Br)cn1C1OC(CO)C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C1OAglycone:
O=c1nc(O)c(Br)c[nH]1Sugarmoiety:
OCC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C3O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.81 |
| AlogP: | -6.03 | Num_rotatable_bonds: | 8 |
| MolWt: | 647.38 | Num_heavy_atoms: | 40 |
| TPSA: | 283.34 | NumAromaticRings: | 1 |
Unique Aglycone
AD45138
Formula: C4H3O2N2Br
Smiles:
O=c1nc(O)c(Br)c[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.24 | Num_rotatable_bonds: | 0 |
| MolWt: | 190.98 | Num_heavy_atoms: | 9 |
| TPSA: | 65.98 | NumAromaticRings: | 1 |
