Glycoside
GD137677
Name:
E-Thesinine-O-4'-Alpha-RhamnosideFormula:
C23H31O7NSmiles:
CC1OC(Oc2ccc(C=CC(=O)OCC3CCN4CCCC34)cc2)C(O)C(O)C1OAglycone:
O=C(C=Cc1ccc(O)cc1)OCC1CCN2CCCC12Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.61 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 6 |
| MolWt: | 433.5 | Num_heavy_atoms: | 31 |
| TPSA: | 108.69 | NumAromaticRings: | 1 |
Unique Aglycone
AD55613
Formula: C17H21O3N
Smiles:
O=C(C=Cc1ccc(O)cc1)OCC1CCN2CCCC12| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.47 |
| AlogP: | 2.43 | Num_rotatable_bonds: | 4 |
| MolWt: | 287.36 | Num_heavy_atoms: | 21 |
| TPSA: | 49.77 | NumAromaticRings: | 1 |
