Glycoside
GD143920
Name:
NoneFormula:
C45H76O18Smiles:
COC1C(OC2C=C3C(O)CC4(O)C(CCC5(C)C(C(C)CCC(COC6OCC(O)C(O)C6OC6OC(C)C(O)C(O)C6O)C(C)C)C(O)C(O)C54)C3(C)CC2)OCC(O)C1OAglycone:
CC(C)C(CO)CCC(C)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(O)C=C3C(O)CC12OSugarmoiety:
CC1OC(OC2C(O)OCC(O)C2O)C(O)C(O)C1O.COC1C(O)OCC(O)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 7 |
| HBD: | 11 | FractionCSP3: | 0.96 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 13 |
| MolWt: | 905.09 | Num_heavy_atoms: | 63 |
| TPSA: | 287.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD57864
Formula: C28H48O6
Smiles:
CC(C)C(CO)CCC(C)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(O)C=C3C(O)CC12O| HBA: | 6 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.93 |
| AlogP: | 2.63 | Num_rotatable_bonds: | 6 |
| MolWt: | 480.69 | Num_heavy_atoms: | 34 |
| TPSA: | 121.38 | NumAromaticRings: | 0 |
