Glycoside
GD152903
Name:
Sublanceoside B1Formula:
C33H48O10Smiles:
COC1CC(OC2CC3=CCC4C(=O)C(c5ccoc5C)CCC4C3(C)CC2O)OC(C)C1OC1CC(O)C(O)C(C)O1Aglycone:
Cc1occc1C1CCC2C(CC=C3CC(O)C(O)CC32C)C1=OSugarmoiety:
COC1CC(O)OC(C)C1OC1CC(O)C(O)C(C)O1Other Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.79 |
| AlogP: | 3.54 | Num_rotatable_bonds: | 6 |
| MolWt: | 604.74 | Num_heavy_atoms: | 43 |
| TPSA: | 137.05 | NumAromaticRings: | 1 |
Unique Aglycone
AD46211
Formula: C20H26O4
Smiles:
Cc1occc1C1CCC2C(CC=C3CC(O)C(O)CC32C)C1=O| HBA: | 4 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.65 |
| AlogP: | 3.12 | Num_rotatable_bonds: | 1 |
| MolWt: | 330.42 | Num_heavy_atoms: | 24 |
| TPSA: | 70.67 | NumAromaticRings: | 1 |
