Glycoside
GD152685
Name:
Cdp-EthanolamineFormula:
C11H20O11N4P2Smiles:
N=c1ccn(C2OC(COP(=O)(O)OP(=O)(O)OCCN)C(O)C2O)c(O)n1Aglycone:
COP(=O)(O)OP(=O)(O)OCCN.N=C1C=C[N]C(O)=N1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.64 |
| AlogP: | -2.1 | Num_rotatable_bonds: | 9 |
| MolWt: | 446.25 | Num_heavy_atoms: | 28 |
| TPSA: | 239.9 | NumAromaticRings: | 1 |
Unique Aglycone
AD21860
Formula: C3H11O7NP2
Smiles:
COP(=O)(O)OP(=O)(O)OCCN| HBA: | 8 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 235.07 | Num_heavy_atoms: | 13 |
| TPSA: | 128.31 | NumAromaticRings: | 0 |
AD45484
Formula: C4H4ON3
Smiles:
N=C1C=C[N]C(O)=N1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 0 |
| MolWt: | 110.1 | Num_heavy_atoms: | 8 |
| TPSA: | 70.54 | NumAromaticRings: | 0 |
