Glycoside
GD122749
Name:
Lactonamycin ZFormula:
C28H27O13NSmiles:
COC12CC(=O)OC13C(=O)c1c(cc4cc(O)c5c(c4c1O)CN(C)C5=O)C(=O)C3(OC1CC(O)C(O)C(C)O1)CO2Aglycone:
COC12CC(=O)OC13C(=O)c1c(cc4cc(O)c5c(c4c1O)CN(C)C5=O)C(=O)C3(O)CO2Sugarmoiety:
CC1OC(O)CC(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 7 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 3 |
| MolWt: | 585.52 | Num_heavy_atoms: | 42 |
| TPSA: | 198.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD49496
Formula: C22H17O10N
Smiles:
COC12CC(=O)OC13C(=O)c1c(cc4cc(O)c5c(c4c1O)CN(C)C5=O)C(=O)C3(O)CO2| HBA: | 11 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 1 |
| MolWt: | 455.38 | Num_heavy_atoms: | 33 |
| TPSA: | 159.9 | NumAromaticRings: | 2 |
