Glycoside
GD006007
Name:
NoneFormula:
C8H16O14P2Smiles:
O=C(O)C1(OP(=O)(O)O)CC(O)C(O)C([C@H](O)COP(=O)(O)O)O1Aglycone:
O=P(O)(O)O.O=P(O)(O)OCCOSugarmoiety:
O=C(O)C1(O)CC(O)C(O)C(O)O1Other Identifiers
Properties
| HBA: | 14 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.88 |
| AlogP: | -3.14 | Num_rotatable_bonds: | 7 |
| MolWt: | 398.15 | Num_heavy_atoms: | 24 |
| TPSA: | 240.74 | NumAromaticRings: | 0 |
Unique Aglycone
AD00019
Formula: H3O4P
Smiles:
O=P(O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 0 |
| MolWt: | 97.99 | Num_heavy_atoms: | 5 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
AD01501
Formula: C2H7O5P
Smiles:
O=P(O)(O)OCCO| HBA: | 5 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.91 | Num_rotatable_bonds: | 3 |
| MolWt: | 142.05 | Num_heavy_atoms: | 8 |
| TPSA: | 86.99 | NumAromaticRings: | 0 |
