Glycoside
GD127293
Name:
11-({6-[({3,4-dihydroxy-6-methyl-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-4,5-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-3-hydroxytetradecanoic acidFormula:
C38H68O21Smiles:
CCCC(CCCCCCCC(O)CC(=O)O)OC1OC(COC2OC(C)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1OC1OC(C)C(O)C(O)C1OAglycone:
CCCC(O)CCCCCCCC(O)CC(=O)OSugarmoiety:
CC1OC(OC2C(C)OC(OCC3OC(O)C(OC4OC(C)C(O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 21 | RingCount: | 4 |
| HBD: | 12 | FractionCSP3: | 0.97 |
| AlogP: | -2.91 | Num_rotatable_bonds: | 21 |
| MolWt: | 860.94 | Num_heavy_atoms: | 59 |
| TPSA: | 333.67 | NumAromaticRings: | 0 |
Unique Aglycone
AD45010
Formula: C14H28O4
Smiles:
CCCC(O)CCCCCCCC(O)CC(=O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.93 |
| AlogP: | 2.71 | Num_rotatable_bonds: | 12 |
| MolWt: | 260.37 | Num_heavy_atoms: | 18 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
