Glycoside
GD033530
Name:
NoneFormula:
C17H28O9N2PBrSmiles:
O=c1c(Br)cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)n1CCCCCCCCP(=O)(O)OAglycone:
O=c1[nH]cc(Br)c(=O)n1CCCCCCCCP(=O)(O)OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.76 |
| AlogP: | -0.1 | Num_rotatable_bonds: | 11 |
| MolWt: | 515.29 | Num_heavy_atoms: | 30 |
| TPSA: | 171.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD21393
Formula: C12H20O5N2PBr
Smiles:
O=c1[nH]cc(Br)c(=O)n1CCCCCCCCP(=O)(O)O| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | 1.82 | Num_rotatable_bonds: | 9 |
| MolWt: | 383.18 | Num_heavy_atoms: | 21 |
| TPSA: | 112.39 | NumAromaticRings: | 1 |
