Glycoside
GD075381
Name:
NoneFormula:
C18H27O7N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)CCC(=O)NCc2cccnc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(CCC(=O)NCc1cccnc1)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -1.56 | Num_rotatable_bonds: | 9 |
| MolWt: | 397.43 | Num_heavy_atoms: | 28 |
| TPSA: | 150.24 | NumAromaticRings: | 1 |
Unique Aglycone
AD34911
Formula: C12H17O3N3
Smiles:
O=C(CCC(=O)NCc1cccnc1)NCCO| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 7 |
| MolWt: | 251.29 | Num_heavy_atoms: | 18 |
| TPSA: | 91.32 | NumAromaticRings: | 1 |
