Glycoside
GD125507
Name:
Neomangicol AFormula:
C26H37O5ClSmiles:
CC1CC2=C3C1=CC1(C)CC(O)C(C)(CC(O)C(O)C(C)(O)CO)C1C3CCC2=CClAglycone:
CC1CC2=C3C1=CC1(C)CC(O)C(C)(C)C1C3CCC2=CClSugarmoiety:
CC(O)(CO)C(O)C(O)OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.76 |
| AlogP: | 3.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 453.02 | Num_heavy_atoms: | 31 |
| TPSA: | 101.15 | NumAromaticRings: | 0 |
Unique Aglycone
AD50760
Formula: C21H27OCl
Smiles:
CC1CC2=C3C1=CC1(C)CC(O)C(C)(C)C1C3CCC2=CCl| HBA: | 1 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.7 |
| AlogP: | 5.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 318.89 | Num_heavy_atoms: | 22 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
