Glycoside
GD092759
Name:
NoneFormula:
C23H29O6N2Smiles:
O[C@@H]1CO[C@](O)(C[NH2+]CCc2c[nH]c3ccc(OCc4ccccc4)cc23)[C@H](O)[C@@H]1OAglycone:
C[NH2+]CCc1c[nH]c2ccc(OCc3ccccc3)cc12Sugarmoiety:
OC1COC(O)(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.39 |
| AlogP: | -0.35 | Num_rotatable_bonds: | 8 |
| MolWt: | 429.49 | Num_heavy_atoms: | 31 |
| TPSA: | 131.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD40356
Formula: C18H21ON2
Smiles:
C[NH2+]CCc1c[nH]c2ccc(OCc3ccccc3)cc12| HBA: | 3 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.22 |
| AlogP: | 2.48 | Num_rotatable_bonds: | 6 |
| MolWt: | 281.38 | Num_heavy_atoms: | 21 |
| TPSA: | 41.63 | NumAromaticRings: | 3 |
