Glycoside
GD073018
Name:
NoneFormula:
C16H23O8N3Smiles:
COc1ccnc(OC2CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)CC2)n1Aglycone:
COc1ccnc(OC2CCNCC2)n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -2.5 | Num_rotatable_bonds: | 8 |
| MolWt: | 385.37 | Num_heavy_atoms: | 27 |
| TPSA: | 162.54 | NumAromaticRings: | 1 |
Unique Aglycone
AD33939
Formula: C10H15O2N3
Smiles:
COc1ccnc(OC2CCNCC2)n1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 3 |
| MolWt: | 209.25 | Num_heavy_atoms: | 15 |
| TPSA: | 56.27 | NumAromaticRings: | 1 |
