Glycoside
GD082359
Name:
NoneFormula:
C17H25O7N5Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cc(N3CCCNC3=O)ncn2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1cc(N2CCCNC2=O)ncn1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 6 |
| MolWt: | 411.42 | Num_heavy_atoms: | 29 |
| TPSA: | 166.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD37004
Formula: C11H15O3N5
Smiles:
O=C(NCCO)c1cc(N2CCCNC2=O)ncn1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 265.27 | Num_heavy_atoms: | 19 |
| TPSA: | 107.45 | NumAromaticRings: | 1 |
