Glycoside
GD117705
Name:
NoneFormula:
C37H62O15Smiles:
CC(C=CC(O)C(C)COC1OCC(O)C(O)C1O)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(OC4OCC(O)C(O)C4O)CC3C(O)CC12OAglycone:
CC(C=CC(O)C(C)CO)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(O)CC3C(O)CC12OSugarmoiety:
OC1COC(O)C(O)C1O.OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 6 |
| HBD: | 11 | FractionCSP3: | 0.95 |
| AlogP: | -1.86 | Num_rotatable_bonds: | 9 |
| MolWt: | 746.89 | Num_heavy_atoms: | 52 |
| TPSA: | 259.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD46968
Formula: C27H46O7
Smiles:
CC(C=CC(O)C(C)CO)C1C(O)C(O)C2C1(C)CCC1C3(C)CCC(O)CC3C(O)CC12O| HBA: | 7 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.93 |
| AlogP: | 1.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 482.66 | Num_heavy_atoms: | 34 |
| TPSA: | 141.61 | NumAromaticRings: | 0 |
