Glycoside
GD128014
Name:
3-(hydroxymethyl)-4-(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}but-3-en-2-yl)oxan-2-oneFormula:
C16H26O9Smiles:
C=CC(COC1OC(CO)C(O)C(O)C1O)C1CCOC(=O)C1COAglycone:
C=CC(CO)C1CCOC(=O)C1COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.81 |
| AlogP: | -2.22 | Num_rotatable_bonds: | 7 |
| MolWt: | 362.38 | Num_heavy_atoms: | 25 |
| TPSA: | 145.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD51858
Formula: C10H16O4
Smiles:
C=CC(CO)C1CCOC(=O)C1CO| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.7 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 200.23 | Num_heavy_atoms: | 14 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
