Glycoside
GD151789
Name:
3-({4,5-dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)decanoic acidFormula:
C22H40O11Smiles:
CCCCCCCC(CC(=O)O)OC1OC(C)C(O)C(O)C1OC1OC(C)C(O)C(O)C1OAglycone:
CCCCCCCC(O)CC(=O)OSugarmoiety:
CC1OC(OC2C(O)OC(C)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.95 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 12 |
| MolWt: | 480.55 | Num_heavy_atoms: | 33 |
| TPSA: | 175.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD24708
Formula: C10H20O3
Smiles:
CCCCCCCC(O)CC(=O)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.9 |
| AlogP: | 2.18 | Num_rotatable_bonds: | 8 |
| MolWt: | 188.27 | Num_heavy_atoms: | 13 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
