Glycoside
GD019947
Name:
FOSFLURIDINE TIDOXILFormula:
C34H62O10N2FPSSmiles:
CCCCCCCCCCCCSCC(COP(=O)(O)OC[C@@H]1O[C@H](n2cc(F)c(=O)[nH]c2=O)[C@H](O)[C@H]1O)OCCCCCCCCCCAglycone:
CCCCCCCCCCCCSCC(COP(=O)(O)OC)OCCCCCCCCCC.O=c1[nH]cc(F)c(=O)[nH]1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.88 |
| AlogP: | 6.61 | Num_rotatable_bonds: | 30 |
| MolWt: | 740.91 | Num_heavy_atoms: | 49 |
| TPSA: | 169.54 | NumAromaticRings: | 1 |
Unique Aglycone
AD01634
Formula: C4H3O2N2F
Smiles:
O=c1[nH]cc(F)c(=O)[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.8 | Num_rotatable_bonds: | 0 |
| MolWt: | 130.08 | Num_heavy_atoms: | 9 |
| TPSA: | 65.72 | NumAromaticRings: | 1 |
AD13845
Formula: C26H55O5PS
Smiles:
CCCCCCCCCCCCSCC(COP(=O)(O)OC)OCCCCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 8.93 | Num_rotatable_bonds: | 27 |
| MolWt: | 510.76 | Num_heavy_atoms: | 33 |
| TPSA: | 64.99 | NumAromaticRings: | 0 |
