Glycoside
GD006896
Name:
NoneFormula:
C23H19O4N2BrSmiles:
OC1COC(n2c3ccc(Br)cc3c3ccc4c5ccccc5[nH]c4c32)C(O)C1OAglycone:
Brc1ccc2[nH]c3c(ccc4c5ccccc5[nH]c43)c2c1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.22 |
| AlogP: | 3.8 | Num_rotatable_bonds: | 1 |
| MolWt: | 467.32 | Num_heavy_atoms: | 30 |
| TPSA: | 90.64 | NumAromaticRings: | 5 |
Unique Aglycone
AD05659
Formula: C18H11N2Br
Smiles:
Brc1ccc2[nH]c3c(ccc4c5ccccc5[nH]c43)c2c1| HBA: | 2 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 5.72 | Num_rotatable_bonds: | 0 |
| MolWt: | 335.2 | Num_heavy_atoms: | 21 |
| TPSA: | 31.58 | NumAromaticRings: | 5 |
