Glycoside
GD157410
Name:
NoneFormula:
C41H66O13Smiles:
CC(=O)OC1C(OC2CCC3(C)C(CCC4C3CCC3(CO)C(C(C)C=CC5CC5C)CCC43)C2)OC(CO)C(O)C1OC1OC(CO)C(O)C(O)C1OAglycone:
CC(C=CC1CC1C)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12COSugarmoiety:
CC(=O)OC1C(O)OC(CO)C(O)C1OC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 7 |
| HBD: | 7 | FractionCSP3: | 0.93 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 11 |
| MolWt: | 766.97 | Num_heavy_atoms: | 54 |
| TPSA: | 204.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD61319
Formula: C27H44O2
Smiles:
CC(C=CC1CC1C)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12CO| HBA: | 2 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.93 |
| AlogP: | 5.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 400.65 | Num_heavy_atoms: | 29 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
