Glycoside
GD004877
Name:
NoneFormula:
C31H46O6N6Smiles:
CC(C)(C)c1cc(C(=O)NCCCCCCNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc(C(C)(C)C)c1OAglycone:
CC(C)(C)c1cc(C(=O)NCCCCCCNc2ncnc3c2N=C[N]3)cc(C(C)(C)C)c1OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.61 |
| AlogP: | 3.14 | Num_rotatable_bonds: | 11 |
| MolWt: | 598.75 | Num_heavy_atoms: | 43 |
| TPSA: | 174.88 | NumAromaticRings: | 3 |
Unique Aglycone
AD04205
Formula: C26H37O2N6
Smiles:
CC(C)(C)c1cc(C(=O)NCCCCCCNc2ncnc3c2N=C[N]3)cc(C(C)(C)C)c1O| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.54 |
| AlogP: | 5.09 | Num_rotatable_bonds: | 9 |
| MolWt: | 465.62 | Num_heavy_atoms: | 34 |
| TPSA: | 113.6 | NumAromaticRings: | 2 |
