Glycoside
GD131825
Name:
Neutramycin DFormula:
C32H50O13Smiles:
COC1C(OCC2C(C)OC(=O)C=CC(C)C(OC3OC(C)CC(O)C3O)CCC(C)C(=O)C=CC3OC32)OC(C)C(O)C1OAglycone:
CC1CCC(O)C(C)C=CC(=O)OC(C)C(CO)C2OC2C=CC1=OSugarmoiety:
CC1CC(O)C(O)C(O)O1.COC1C(O)OC(C)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 6 |
| MolWt: | 642.74 | Num_heavy_atoms: | 45 |
| TPSA: | 182.97 | NumAromaticRings: | 0 |
Unique Aglycone
AD19078
Formula: C19H28O6
Smiles:
CC1CCC(O)C(C)C=CC(=O)OC(C)C(CO)C2OC2C=CC1=O| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.68 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 1 |
| MolWt: | 352.43 | Num_heavy_atoms: | 25 |
| TPSA: | 96.36 | NumAromaticRings: | 0 |
