Glycoside
GD047472
Name:
NoneFormula:
C11H18O6N4Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cnn[nH]2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1cnn[nH]1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.73 |
| AlogP: | -2.62 | Num_rotatable_bonds: | 5 |
| MolWt: | 302.29 | Num_heavy_atoms: | 21 |
| TPSA: | 149.82 | NumAromaticRings: | 1 |
Unique Aglycone
AD25519
Formula: C5H8O2N4
Smiles:
O=C(NCCO)c1cnn[nH]1| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 3 |
| MolWt: | 156.15 | Num_heavy_atoms: | 11 |
| TPSA: | 90.9 | NumAromaticRings: | 1 |
