Glycoside
GD123767
Name:
Tupichinin AFormula:
C27H40O8Smiles:
CC(=O)C1=CCC2C3CC=C4CC(OC5OC(CO)C(O)C(O)C5O)CC(O)C4(C)C3CCC12CAglycone:
CC(=O)C1=CCC2C3CC=C4CC(O)CC(O)C4(C)C3CCC12CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.81 |
| AlogP: | 1.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 492.61 | Num_heavy_atoms: | 35 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD46837
Formula: C21H30O3
Smiles:
CC(=O)C1=CCC2C3CC=C4CC(O)CC(O)C4(C)C3CCC12C| HBA: | 3 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.76 |
| AlogP: | 3.41 | Num_rotatable_bonds: | 1 |
| MolWt: | 330.47 | Num_heavy_atoms: | 24 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
