Glycoside
GD022891
Name:
NoneFormula:
C24H30O5N7Smiles:
CNC(=O)[C@@H]1O[C@H](n2cnc3c(NCc4ccc5c(c4)C(C)(C)N([O])C5(C)C)ncnc32)[C@H](O)[C@H]1OAglycone:
CC1(C)c2ccc(CNc3ncnc4c3N=C[N]4)cc2C(C)(C)N1OSugarmoiety:
CNC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 5 |
| MolWt: | 496.55 | Num_heavy_atoms: | 36 |
| TPSA: | 157.56 | NumAromaticRings: | 3 |
Unique Aglycone
AD15463
Formula: C18H21ON6
Smiles:
CC1(C)c2ccc(CNc3ncnc4c3N=C[N]4)cc2C(C)(C)N1O| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.39 |
| AlogP: | 3.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 337.41 | Num_heavy_atoms: | 25 |
| TPSA: | 87.74 | NumAromaticRings: | 2 |
