Glycoside
GD151817
Name:
NoneFormula:
C41H68O13Smiles:
CC=C(CCC(C)C1CCC2C3CCC4CC(OC5OC(CO)C(O)C(O)C5OC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12C(=O)O)C(C)CAglycone:
CC=C(CCC(C)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C(=O)O)C(C)CSugarmoiety:
OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 0.93 |
| AlogP: | 2.74 | Num_rotatable_bonds: | 12 |
| MolWt: | 768.98 | Num_heavy_atoms: | 54 |
| TPSA: | 215.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD60508
Formula: C29H48O3
Smiles:
CC=C(CCC(C)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C(=O)O)C(C)C| HBA: | 3 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.9 |
| AlogP: | 7.09 | Num_rotatable_bonds: | 6 |
| MolWt: | 444.7 | Num_heavy_atoms: | 32 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
