Glycoside
GD124717
Name:
3-({3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]dec-5-enoyl}oxy)dodecanoic acidFormula:
C28H50O9Smiles:
CCCCC=CCC(CC(=O)OC(CCCCCCCCC)CC(=O)O)OC1OC(C)C(O)C(O)C1OAglycone:
CCCCC=CCC(O)CC(=O)OC(CCCCCCCCC)CC(=O)OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.86 |
| AlogP: | 4.25 | Num_rotatable_bonds: | 20 |
| MolWt: | 530.7 | Num_heavy_atoms: | 37 |
| TPSA: | 142.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD50403
Formula: C22H40O5
Smiles:
CCCCC=CCC(O)CC(=O)OC(CCCCCCCCC)CC(=O)O| HBA: | 5 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.82 |
| AlogP: | 5.4 | Num_rotatable_bonds: | 18 |
| MolWt: | 384.56 | Num_heavy_atoms: | 27 |
| TPSA: | 83.83 | NumAromaticRings: | 0 |
