Glycoside
GD133399
Name:
Dendroside DFormula:
C27H44O14Smiles:
CC1CCC2C1C1C(CCC2(O)COC2OC(CO)C(O)C(O)C2O)C1(C)C(=O)OC1OC(CO)C(O)C(O)C1OAglycone:
CC1CCC2C1C1C(CCC2(O)CO)C1(C)C(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.96 |
| AlogP: | -3.41 | Num_rotatable_bonds: | 7 |
| MolWt: | 592.64 | Num_heavy_atoms: | 41 |
| TPSA: | 236.06 | NumAromaticRings: | 0 |
Unique Aglycone
AD53998
Formula: C15H24O4
Smiles:
CC1CCC2C1C1C(CCC2(O)CO)C1(C)C(=O)O| HBA: | 4 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.93 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 2 |
| MolWt: | 268.35 | Num_heavy_atoms: | 19 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
