Glycoside
GD135711
Name:
Naquihexcin KFormula:
C23H24O13Smiles:
COC(=O)CC1CC23OC2(C(=O)c2c(OC4OC(C(=O)O)C(O)C(O)C4O)cccc2C3=O)C(C)O1Aglycone:
COC(=O)CC1CC23OC2(C(=O)c2c(O)cccc2C3=O)C(C)O1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 5 |
| MolWt: | 508.43 | Num_heavy_atoms: | 36 |
| TPSA: | 198.65 | NumAromaticRings: | 1 |
Unique Aglycone
AD54869
Formula: C17H16O7
Smiles:
COC(=O)CC1CC23OC2(C(=O)c2c(O)cccc2C3=O)C(C)O1| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.47 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 2 |
| MolWt: | 332.31 | Num_heavy_atoms: | 24 |
| TPSA: | 102.43 | NumAromaticRings: | 1 |
