Glycoside
GD124350
Name:
1,9-dihydroxy-7-methyl-11-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,10-dihydro-2-azatetraphene-5,10-dioneFormula:
C24H21O10NSmiles:
Cc1cc(O)c2c(c1)C(=O)c1c(c(OC3OC(CO)C(O)C(O)C3O)cc3c(O)nccc13)C2=OAglycone:
Cc1cc(O)c2c(c1)C(=O)c1c(c(O)cc3c(O)nccc13)C2=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.29 |
| AlogP: | -0.09 | Num_rotatable_bonds: | 3 |
| MolWt: | 483.43 | Num_heavy_atoms: | 35 |
| TPSA: | 186.87 | NumAromaticRings: | 3 |
Unique Aglycone
AD50228
Formula: C18H11O5N
Smiles:
Cc1cc(O)c2c(c1)C(=O)c1c(c(O)cc3c(O)nccc13)C2=O| HBA: | 6 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.06 |
| AlogP: | 2.44 | Num_rotatable_bonds: | 0 |
| MolWt: | 321.29 | Num_heavy_atoms: | 24 |
| TPSA: | 107.72 | NumAromaticRings: | 3 |
