Glycoside
GD037403
Name:
NoneFormula:
C18H24O6N2Smiles:
Cc1c(C#CC2CCCCC2)c(=O)[nH]c(=O)n1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Cc1[nH]c(=O)[nH]c(=O)c1C#CC1CCCCC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.61 | Num_rotatable_bonds: | 2 |
| MolWt: | 364.4 | Num_heavy_atoms: | 26 |
| TPSA: | 124.78 | NumAromaticRings: | 1 |
Unique Aglycone
AD23566
Formula: C13H16O2N2
Smiles:
Cc1[nH]c(=O)[nH]c(=O)c1C#CC1CCCCC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.54 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 0 |
| MolWt: | 232.28 | Num_heavy_atoms: | 17 |
| TPSA: | 65.72 | NumAromaticRings: | 1 |
