Glycoside
GD124814
Name:
11,11'-o-dimethylelaiophylinFormula:
C58H96O16Smiles:
CCC1C(C)OC(OC)(C(C)C(O)C(C)C2OC(=O)C=CC=CC(C)C(C(C)C(O)C(C)C3(OC)CC(OC4CC(O)C(O)C(C)O4)C(CC)C(C)O3)OC(=O)C=CC=CC2C)CC1OC1CC(C)C(C)C(C)O1Aglycone:
CCC1C(O)CC(OC)(C(C)C(O)C(C)C2OC(=O)C=CC=CC(C)C(C(C)C(O)C(C)C3(OC)CC(OC4CC(C)C(C)C(C)O4)C(CC)C(C)O3)OC(=O)C=CC=CC2C)OC1CSugarmoiety:
CC1OC(O)CC(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.83 |
| AlogP: | 7.98 | Num_rotatable_bonds: | 16 |
| MolWt: | 1049.39 | Num_heavy_atoms: | 74 |
| TPSA: | 207.36 | NumAromaticRings: | 0 |
Unique Aglycone
AD50446
Formula: C52H86O13
Smiles:
CCC1C(O)CC(OC)(C(C)C(O)C(C)C2OC(=O)C=CC=CC(C)C(C(C)C(O)C(C)C3(OC)CC(OC4CC(C)C(C)C(C)O4)C(CC)C(C)O3)OC(=O)C=CC=CC2C)OC1C| HBA: | 13 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.81 |
| AlogP: | 8.1 | Num_rotatable_bonds: | 14 |
| MolWt: | 919.25 | Num_heavy_atoms: | 65 |
| TPSA: | 168.67 | NumAromaticRings: | 0 |
