Glycoside
GD092758
Name:
NoneFormula:
C23H29O6N2Smiles:
O[C@H]1[C@H](O)[C@H](O)CO[C@@]1(O)C[NH2+]CCc1c[nH]c2ccc(OCc3ccccc3)cc12Aglycone:
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 |
