Glycoside
GD156778
Name:
2-({1-ethenyl-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl}oxy)oxane-3,4,5-triolFormula:
C25H34O5Smiles:
C=CC1CCC2C3CCc4cc(OC5OCC(O)C(O)C5O)ccc4C3CCC12CAglycone:
C=CC1CCC2C3CCc4cc(O)ccc4C3CCC12CSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.68 |
| AlogP: | 3.16 | Num_rotatable_bonds: | 3 |
| MolWt: | 414.54 | Num_heavy_atoms: | 30 |
| TPSA: | 79.15 | NumAromaticRings: | 1 |
Unique Aglycone
AD16931
Formula: C20H26O
Smiles:
C=CC1CCC2C3CCc4cc(O)ccc4C3CCC12C| HBA: | 1 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 5.05 | Num_rotatable_bonds: | 1 |
| MolWt: | 282.43 | Num_heavy_atoms: | 21 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
