Glycoside
GD116812
Name:
2-(hydroxymethyl)-6-{[4-methyl-1-(propan-2-yl)-7-oxabicyclo[4.1.0]hept-3-en-2-yl]oxy}oxane-3,4,5-triolFormula:
C16H26O7Smiles:
CC1=CC(OC2OC(CO)C(O)C(O)C2O)C2(C(C)C)OC2C1Aglycone:
CC1=CC(O)C2(C(C)C)OC2C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.88 |
| AlogP: | -0.68 | Num_rotatable_bonds: | 4 |
| MolWt: | 330.38 | Num_heavy_atoms: | 23 |
| TPSA: | 111.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD46462
Formula: C10H16O2
Smiles:
CC1=CC(O)C2(C(C)C)OC2C1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 1.49 | Num_rotatable_bonds: | 1 |
| MolWt: | 168.24 | Num_heavy_atoms: | 12 |
| TPSA: | 32.76 | NumAromaticRings: | 0 |
