Glycoside
GD123133
Name:
methyl 2-[2-(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexyl)cyclopropyl]acetateFormula:
C18H32O8Smiles:
CCC(CCCC1CC1CC(=O)OC)OC1OC(CO)C(O)C(O)C1OAglycone:
CCC(O)CCCC1CC1CC(=O)OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.94 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 10 |
| MolWt: | 376.45 | Num_heavy_atoms: | 26 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD49667
Formula: C12H22O3
Smiles:
CCC(O)CCCC1CC1CC(=O)OC| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.92 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 7 |
| MolWt: | 214.3 | Num_heavy_atoms: | 15 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
