Glycoside
GD000114
Name:
NoneFormula:
C20H31O4N5Smiles:
CCCCN(C=Cc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O)CCCCAglycone:
CCCCN(C=Cc1ncnc2c1N=C[N]2)CCCCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.65 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 10 |
| MolWt: | 405.5 | Num_heavy_atoms: | 29 |
| TPSA: | 116.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD00140
Formula: C15H22N5
Smiles:
CCCCN(C=Cc1ncnc2c1N=C[N]2)CCCC| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.53 |
| AlogP: | 3.26 | Num_rotatable_bonds: | 8 |
| MolWt: | 272.38 | Num_heavy_atoms: | 20 |
| TPSA: | 55.48 | NumAromaticRings: | 1 |
