Glycoside
GD082281
Name:
NoneFormula:
C17H26O9N2Smiles:
COc1cc(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)c(OC)nc1OCAglycone:
COc1cc(C(=O)NCCO)c(OC)nc1OCSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | -1.32 | Num_rotatable_bonds: | 8 |
| MolWt: | 402.4 | Num_heavy_atoms: | 28 |
| TPSA: | 148.83 | NumAromaticRings: | 1 |
Unique Aglycone
AD36955
Formula: C11H16O5N2
Smiles:
COc1cc(C(=O)NCCO)c(OC)nc1OC| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 256.26 | Num_heavy_atoms: | 18 |
| TPSA: | 89.91 | NumAromaticRings: | 1 |
