Glycoside
GD147060
Name:
Dongtingnoid CFormula:
C26H40O9Smiles:
COCC1OC(OC2C3=C(C(C)C)CCC3(C)C(O)C3=C(CCC3=O)C(C)C2O)C(O)C(O)C1OAglycone:
CC(C)C1=C2C(O)C(O)C(C)C3=C(C(=O)CC3)C(O)C2(C)CC1Sugarmoiety:
COCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.81 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 5 |
| MolWt: | 496.6 | Num_heavy_atoms: | 35 |
| TPSA: | 145.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD58907
Formula: C19H28O4
Smiles:
CC(C)C1=C2C(O)C(O)C(C)C3=C(C(=O)CC3)C(O)C2(C)CC1| HBA: | 4 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.74 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 320.43 | Num_heavy_atoms: | 23 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
