Glycoside
GD139816
Name:
Altromycin AFormula:
C46H57O18NSmiles:
CNC1(C)CC(c2ccc3c(c2O)C(=O)c2c(cc(C(O)(C(=O)OC)C4OC(C)C(O)C(OC)C4O)c4c(=O)cc(C5(C)OC5C)oc24)C3=O)OC(C)C1OC1COC(C)C(O)C1OCAglycone:
CNC1(C)CC(c2ccc3c(c2O)C(=O)c2c(cc(C(O)C(=O)OC)c4c(=O)cc(C5(C)OC5C)oc24)C3=O)OC(C)C1OSugarmoiety:
COC1C(O)C(C)OC(O)C1O.COC1C(O)COC(C)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 8 |
| HBD: | 6 | FractionCSP3: | 0.61 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 10 |
| MolWt: | 911.95 | Num_heavy_atoms: | 65 |
| TPSA: | 271.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD56386
Formula: C32H33O11N
Smiles:
CNC1(C)CC(c2ccc3c(c2O)C(=O)c2c(cc(C(O)C(=O)OC)c4c(=O)cc(C5(C)OC5C)oc24)C3=O)OC(C)C1O| HBA: | 12 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 5 |
| MolWt: | 607.61 | Num_heavy_atoms: | 44 |
| TPSA: | 185.13 | NumAromaticRings: | 3 |
