Glycoside
GD014254
Name:
NoneFormula:
C21H33O5N9Smiles:
NCCCN(CCCN)CC(=O)NCC#Cc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
NCCCN(CCCN)CC(=O)NCC#Cc1nc(N)c2c(n1)[N]C=N2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 0.62 |
| AlogP: | -3.51 | Num_rotatable_bonds: | 11 |
| MolWt: | 491.55 | Num_heavy_atoms: | 35 |
| TPSA: | 223.92 | NumAromaticRings: | 2 |
Unique Aglycone
AD10503
Formula: C16H24ON9
Smiles:
NCCCN(CCCN)CC(=O)NCC#Cc1nc(N)c2c(n1)[N]C=N2| HBA: | 10 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -1.56 | Num_rotatable_bonds: | 9 |
| MolWt: | 358.43 | Num_heavy_atoms: | 26 |
| TPSA: | 162.64 | NumAromaticRings: | 1 |
