Glycoside
GD113853
Name:
NoneFormula:
C38H46O11Smiles:
COC(=O)[C@H]1O[C@@H](O[C@H]2CC[C@H]3[C@@H]4CCc5cc(OCc6ccccc6)ccc5[C@H]4CC[C@]23C)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=OAglycone:
CC12CCC3c4ccc(OCc5ccccc5)cc4CCC3C1CCC2OSugarmoiety:
COC(=O)C1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 0 | FractionCSP3: | 0.58 |
| AlogP: | 5.2 | Num_rotatable_bonds: | 9 |
| MolWt: | 678.78 | Num_heavy_atoms: | 49 |
| TPSA: | 132.89 | NumAromaticRings: | 2 |
Unique Aglycone
AD44833
Formula: C25H30O2
Smiles:
CC12CCC3c4ccc(OCc5ccccc5)cc4CCC3C1CCC2O| HBA: | 2 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.52 |
| AlogP: | 5.48 | Num_rotatable_bonds: | 3 |
| MolWt: | 362.51 | Num_heavy_atoms: | 27 |
| TPSA: | 29.46 | NumAromaticRings: | 2 |
