Glycoside
GD056953
Name:
NoneFormula:
C14H17O7N3Smiles:
COc1cnc(-c2noc(C(=O)[C@H](O)[C@H](O)[C@H](O)CO)n2)c(C)c1Aglycone:
COc1cnc(-c2ncon2)c(C)c1Sugarmoiety:
O=C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -1.29 | Num_rotatable_bonds: | 7 |
| MolWt: | 339.3 | Num_heavy_atoms: | 24 |
| TPSA: | 159.03 | NumAromaticRings: | 2 |
Unique Aglycone
AD28618
Formula: C9H9O2N3
Smiles:
COc1cnc(-c2ncon2)c(C)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.22 |
| AlogP: | 1.45 | Num_rotatable_bonds: | 2 |
| MolWt: | 191.19 | Num_heavy_atoms: | 14 |
| TPSA: | 61.04 | NumAromaticRings: | 2 |
