Glycoside
GD114815
Name:
1'-O-Bacchabolivyl XylopyranosideFormula:
C25H36O7Smiles:
CC1=CCCC2C1(C)CCC(C(=O)OC1OCC(O)C(O)C1O)C2(C)CCc1ccoc1Aglycone:
CC1=CCCC2C1(C)CCC(C(=O)O)C2(C)CCc1ccoc1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.72 |
| AlogP: | 2.97 | Num_rotatable_bonds: | 5 |
| MolWt: | 448.56 | Num_heavy_atoms: | 32 |
| TPSA: | 109.36 | NumAromaticRings: | 1 |
Unique Aglycone
AD45304
Formula: C20H28O3
Smiles:
CC1=CCCC2C1(C)CCC(C(=O)O)C2(C)CCc1ccoc1| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.65 |
| AlogP: | 5.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 316.44 | Num_heavy_atoms: | 23 |
| TPSA: | 50.44 | NumAromaticRings: | 1 |
