Glycoside
GD133560
Name:
4'-Acetylchrysomycin AFormula:
C30H30O10Smiles:
C=Cc1cc(OC)c2c(c1)c(=O)oc1c2cc(OC)c2c(O)ccc(C3OC(C)C(OC(C)=O)C(C)(O)C3O)c21Aglycone:
C=Cc1cc(OC)c2c(c1)c(=O)oc1c3cccc(O)c3c(OC)cc12Sugarmoiety:
CC(=O)OC1C(C)OC(O)C(O)C1(C)OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 3.97 | Num_rotatable_bonds: | 5 |
| MolWt: | 550.56 | Num_heavy_atoms: | 40 |
| TPSA: | 144.89 | NumAromaticRings: | 4 |
Unique Aglycone
AD02034
Formula: C21H16O5
Smiles:
C=Cc1cc(OC)c2c(c1)c(=O)oc1c3cccc(O)c3c(OC)cc12| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 4.47 | Num_rotatable_bonds: | 3 |
| MolWt: | 348.35 | Num_heavy_atoms: | 26 |
| TPSA: | 68.9 | NumAromaticRings: | 4 |
