Glycoside
GD139465
Name:
Ryobunin BFormula:
C36H58O11Smiles:
CC(=O)C(C)CCC1(C(=O)OC2OC(CO)C(O)C(O)C2O)C=C2C(O)CC3C4(C)CCC(O)C(C)(CO)C4CCC3(C)C2(C)CC1Aglycone:
CC(=O)C(C)CCC1(C(=O)O)C=C2C(O)CC3C4(C)CCC(O)C(C)(CO)C4CCC3(C)C2(C)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.89 |
| AlogP: | 2.0 | Num_rotatable_bonds: | 8 |
| MolWt: | 666.85 | Num_heavy_atoms: | 47 |
| TPSA: | 194.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD56235
Formula: C30H48O6
Smiles:
CC(=O)C(C)CCC1(C(=O)O)C=C2C(O)CC3C4(C)CCC(O)C(C)(CO)C4CCC3(C)C2(C)CC1| HBA: | 6 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.87 |
| AlogP: | 4.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 504.71 | Num_heavy_atoms: | 36 |
| TPSA: | 115.06 | NumAromaticRings: | 0 |
