Glycoside
GD134594
Name:
N-[4-hydroxy-2-(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-pyran-5-yl]acetamideFormula:
C14H23O10NSmiles:
CC(O)=NC1=COC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1OAglycone:
CC(O)=NC1=COC(CO)C(O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.79 |
| AlogP: | -3.26 | Num_rotatable_bonds: | 5 |
| MolWt: | 365.34 | Num_heavy_atoms: | 25 |
| TPSA: | 181.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD50937
Formula: C8H13O5N
Smiles:
CC(O)=NC1=COC(CO)C(O)C1O| HBA: | 6 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 2 |
| MolWt: | 203.19 | Num_heavy_atoms: | 14 |
| TPSA: | 102.51 | NumAromaticRings: | 0 |
