Glycoside
GD157827
Name:
NoneFormula:
C35H62O11Smiles:
COC(CO)C1OC(OCC(O)(CCC(C)C2CC(O)C3C2(C)CCC2C4(C)CCC(O)CC4C(O)CC23O)C(C)C)C(O)C1OAglycone:
CC(CCC(O)(CO)C(C)C)C1CC(O)C2C1(C)CCC1C3(C)CCC(O)CC3C(O)CC12O.COCCOSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 1.0 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 11 |
| MolWt: | 658.87 | Num_heavy_atoms: | 46 |
| TPSA: | 189.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD00384
Formula: C3H8O2
Smiles:
COCCO| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 2 |
| MolWt: | 76.09 | Num_heavy_atoms: | 5 |
| TPSA: | 29.46 | NumAromaticRings: | 0 |
AD62358
Formula: C28H50O6
Smiles:
CC(CCC(O)(CO)C(C)C)C1CC(O)C2C1(C)CCC1C3(C)CCC(O)CC3C(O)CC12O| HBA: | 6 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | 2.86 | Num_rotatable_bonds: | 6 |
| MolWt: | 482.7 | Num_heavy_atoms: | 34 |
| TPSA: | 121.38 | NumAromaticRings: | 0 |
