Glycoside
GD145601
Name:
4-hydroxy-4a-(hydroxymethyl)-7-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-decahydronaphthalen-1-oneFormula:
C20H34O9Smiles:
CC(C)(OC1OC(CO)C(O)C(O)C1O)C1CCC2(CO)C(O)CCC(=O)C2C1Aglycone:
CC(C)(O)C1CCC2(CO)C(O)CCC(=O)C2C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.95 |
| AlogP: | -1.3 | Num_rotatable_bonds: | 5 |
| MolWt: | 418.48 | Num_heavy_atoms: | 29 |
| TPSA: | 156.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD58428
Formula: C14H24O4
Smiles:
CC(C)(O)C1CCC2(CO)C(O)CCC(=O)C2C1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.93 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 2 |
| MolWt: | 256.34 | Num_heavy_atoms: | 18 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
