Glycoside
GD157819
Name:
2-({1-ethenyl-7-hydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-6-yl}oxy)-3,5-dihydroxyoxan-4-yl acetateFormula:
C28H44O7Smiles:
C=CC1CCC2C3CCC4C(OC5OCC(O)C(OC(C)=O)C5O)C(O)CCC4(C)C3CCC12CAglycone:
C=CC1CCC2C3CCC4C(O)C(O)CCC4(C)C3CCC12CSugarmoiety:
CC(=O)OC1C(O)COC(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.89 |
| AlogP: | 3.2 | Num_rotatable_bonds: | 4 |
| MolWt: | 492.65 | Num_heavy_atoms: | 35 |
| TPSA: | 105.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD17554
Formula: C21H34O2
Smiles:
C=CC1CCC2C3CCC4C(O)C(O)CCC4(C)C3CCC12C| HBA: | 2 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.9 |
| AlogP: | 4.16 | Num_rotatable_bonds: | 1 |
| MolWt: | 318.5 | Num_heavy_atoms: | 23 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
