Glycoside
GD037325
Name:
NoneFormula:
C24H26O7NClSmiles:
OC[C@@H]1O[C@H](c2cc(Cc3ccc4c(c3)NCCO4)c(Cl)c3c2CCO3)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1c(Cc2ccc3c(c2)NCCO3)ccc2c1OCC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 4 |
| MolWt: | 463.91 | Num_heavy_atoms: | 32 |
| TPSA: | 120.64 | NumAromaticRings: | 2 |
Unique Aglycone
AD23520
Formula: C18H16O2NCl
Smiles:
Clc1c(Cc2ccc3c(c2)NCCO3)ccc2c1OCC2| HBA: | 3 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.29 |
| AlogP: | 3.67 | Num_rotatable_bonds: | 2 |
| MolWt: | 301.77 | Num_heavy_atoms: | 21 |
| TPSA: | 30.49 | NumAromaticRings: | 2 |
