Glycoside
GD138606
Name:
NoneFormula:
C40H62O12Smiles:
CC(C)=CC(=O)CC(C)C1CC=C2C3=C(CCC21C)C1(C)CCC(OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(C)C1CC3Aglycone:
CC(C)=CC(=O)CC(C)C1CC=C2C3=C(CCC21C)C1(C)CCC(O)C(C)C1CC3Sugarmoiety:
OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.82 |
| AlogP: | 2.45 | Num_rotatable_bonds: | 10 |
| MolWt: | 734.92 | Num_heavy_atoms: | 52 |
| TPSA: | 195.6 | NumAromaticRings: | 0 |
Unique Aglycone
AD55932
Formula: C28H42O2
Smiles:
CC(C)=CC(=O)CC(C)C1CC=C2C3=C(CCC21C)C1(C)CCC(O)C(C)C1CC3| HBA: | 2 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | 6.8 | Num_rotatable_bonds: | 4 |
| MolWt: | 410.64 | Num_heavy_atoms: | 30 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
