Glycoside
GD085635
Name:
NoneFormula:
C21H21O8NSmiles:
Cc1oc2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3O)ccc2c(=O)c1-c1ccccn1Aglycone:
Cc1oc2cc(O)ccc2c(=O)c1-c1ccccn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 415.4 | Num_heavy_atoms: | 30 |
| TPSA: | 142.48 | NumAromaticRings: | 3 |
Unique Aglycone
AD38140
Formula: C15H11O3N
Smiles:
Cc1oc2cc(O)ccc2c(=O)c1-c1ccccn1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 2.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 253.26 | Num_heavy_atoms: | 19 |
| TPSA: | 63.33 | NumAromaticRings: | 3 |
