Glycoside
GD005726
Name:
NoneFormula:
C23H25O5N2Smiles:
CO[C@H]1[C@H](O)[C@@H]([n+]2ccc3c(C)c4[nH]c5ccc(O)cc5c4c(C)c3c2)OC[C@H]1OAglycone:
Cc1c2cc[nH+]cc2c(C)c2c1[nH]c1ccc(O)cc12Sugarmoiety:
COC1C(O)COC(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 2.35 | Num_rotatable_bonds: | 2 |
| MolWt: | 409.46 | Num_heavy_atoms: | 30 |
| TPSA: | 98.82 | NumAromaticRings: | 4 |
Unique Aglycone
AD02350
Formula: C17H15ON2
Smiles:
Cc1c2cc[nH+]cc2c(C)c2c1[nH]c1ccc(O)cc12| HBA: | 3 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 3.61 | Num_rotatable_bonds: | 0 |
| MolWt: | 263.32 | Num_heavy_atoms: | 20 |
| TPSA: | 50.16 | NumAromaticRings: | 4 |
