Glycoside
GD062351
Name:
NoneFormula:
C10H15O11N2PSmiles:
O=C(O)c1cc(=O)[nH]c(=O)n1[C@@H]1O[C@H](CO[PH](O)(O)O)[C@H](O)[C@@H]1OAglycone:
CO[PH](O)(O)O.O=C(O)c1cc(=O)[nH]c(=O)[nH]1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -3.74 | Num_rotatable_bonds: | 5 |
| MolWt: | 370.21 | Num_heavy_atoms: | 24 |
| TPSA: | 211.77 | NumAromaticRings: | 1 |
Unique Aglycone
AD01852
Formula: CH7O4P
Smiles:
CO[PH](O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 1 |
| MolWt: | 114.04 | Num_heavy_atoms: | 6 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
AD18265
Formula: C5H4O4N2
Smiles:
O=C(O)c1cc(=O)[nH]c(=O)[nH]1| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -1.24 | Num_rotatable_bonds: | 1 |
| MolWt: | 156.1 | Num_heavy_atoms: | 11 |
| TPSA: | 103.02 | NumAromaticRings: | 1 |
