Glycoside
GD122182
Name:
NoneFormula:
C45H70O16Smiles:
COC1C(C)OC(OC2C(OC(C)=O)COC(OC3CC4CC(=O)C5(O)OC(CC5C)C(C)(C)C(C=CC=CC=CC(C)C)OC(=O)CC(O4)C3C)C2OC)C(OC)C1OCAglycone:
CC(C)C=CC=CC=CC1OC(=O)CC2OC(CC(=O)C3(O)OC(CC3C)C1(C)C)CC(O)C2CSugarmoiety:
COC1C(C)OC(OC2C(OC(C)=O)COC(O)C2OC)C(OC)C1OCOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 4.38 | Num_rotatable_bonds: | 13 |
| MolWt: | 867.04 | Num_heavy_atoms: | 61 |
| TPSA: | 182.2 | NumAromaticRings: | 0 |
Unique Aglycone
AD16283
Formula: C28H42O7
Smiles:
CC(C)C=CC=CC=CC1OC(=O)CC2OC(CC(=O)C3(O)OC(CC3C)C1(C)C)CC(O)C2C| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.71 |
| AlogP: | 3.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 490.64 | Num_heavy_atoms: | 35 |
| TPSA: | 102.29 | NumAromaticRings: | 0 |
