Glycoside
GD031504
Name:
NoneFormula:
C36H60O7Smiles:
CC=C(C(C)C)[C@H](O)C[C@H](C)[C@@H]1CC[C@]2(C)[C@@H]3CC[C@@H]4[C@H](C)[C@H](O[C@@H]5OC[C@H](O)[C@H](O)[C@H]5O)CC[C@@]4(O)CC3=CC[C@]12CAglycone:
CC=C(C(C)C)C(O)CC(C)C1CCC2(C)C3CCC4C(C)C(O)CCC4(O)CC3=CCC12CSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.89 |
| AlogP: | 5.13 | Num_rotatable_bonds: | 7 |
| MolWt: | 604.87 | Num_heavy_atoms: | 43 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD20289
Formula: C31H52O3
Smiles:
CC=C(C(C)C)C(O)CC(C)C1CCC2(C)C3CCC4C(C)C(O)CCC4(O)CC3=CCC12C| HBA: | 3 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.87 |
| AlogP: | 6.67 | Num_rotatable_bonds: | 5 |
| MolWt: | 472.75 | Num_heavy_atoms: | 34 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
