Glycoside
GD095264
Name:
NoneFormula:
C22H28O7N4Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@H](Cc2ccccc2)NC(=O)c2cnccn2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NC(Cc1ccccc1)C(=O)NCCO)c1cnccn1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -1.22 | Num_rotatable_bonds: | 9 |
| MolWt: | 460.49 | Num_heavy_atoms: | 33 |
| TPSA: | 163.13 | NumAromaticRings: | 2 |
Unique Aglycone
AD40655
Formula: C16H18O3N4
Smiles:
O=C(NC(Cc1ccccc1)C(=O)NCCO)c1cnccn1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 7 |
| MolWt: | 314.34 | Num_heavy_atoms: | 23 |
| TPSA: | 104.21 | NumAromaticRings: | 2 |
