Glycoside
GD079179
Name:
NoneFormula:
C8H17O12N3P2Smiles:
O=c1cnn([C@@H]2O[C@@H](CO[PH](O)(O)O[PH](O)(O)O)[C@@H](O)[C@@H]2O)c(=O)[nH]1Aglycone:
CO[PH](O)(O)O[PH](O)(O)O.O=c1cn[nH]c(=O)[nH]1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.62 |
| AlogP: | -4.63 | Num_rotatable_bonds: | 6 |
| MolWt: | 409.18 | Num_heavy_atoms: | 25 |
| TPSA: | 237.05 | NumAromaticRings: | 1 |
Unique Aglycone
AD07645
Formula: C3H3O2N3
Smiles:
O=c1cn[nH]c(=O)[nH]1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 0 |
| MolWt: | 113.08 | Num_heavy_atoms: | 8 |
| TPSA: | 78.61 | NumAromaticRings: | 1 |
AD36283
Formula: CH10O7P2
Smiles:
CO[PH](O)(O)O[PH](O)(O)O| HBA: | 7 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | -1.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 196.03 | Num_heavy_atoms: | 10 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
