Glycoside
GD117336
Name:
SarmentolosideFormula:
C29H44O11Smiles:
CC1OC(OC2CCC3(CO)C4C(O)CC5(C)C(C6=CC(=O)OC6)CCC5(O)C4CCC3(O)C2)C(O)C(O)C1OAglycone:
CC12CC(O)C3C(CCC4(O)CC(O)CCC34CO)C1(O)CCC2C1=CC(=O)OC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.9 |
| AlogP: | -0.49 | Num_rotatable_bonds: | 4 |
| MolWt: | 568.66 | Num_heavy_atoms: | 40 |
| TPSA: | 186.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD19871
Formula: C23H34O7
Smiles:
CC12CC(O)C3C(CCC4(O)CC(O)CCC34CO)C1(O)CCC2C1=CC(=O)OC1| HBA: | 7 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.87 |
| AlogP: | 0.66 | Num_rotatable_bonds: | 2 |
| MolWt: | 422.52 | Num_heavy_atoms: | 30 |
| TPSA: | 127.45 | NumAromaticRings: | 0 |
