Glycoside
GD136289
Name:
Neutramycin GFormula:
C26H40O11Smiles:
COC1C(OCC2C(C)OC(=O)C=CC(C)C(O)CCC(C)(O)C(=O)C=CC3OC32)OC(C)C(O)C1OAglycone:
CC1C=CC(=O)OC(C)C(CO)C2OC2C=CC(=O)C(C)(O)CCC1OSugarmoiety:
COC1C(O)OC(C)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.77 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 528.6 | Num_heavy_atoms: | 37 |
| TPSA: | 164.51 | NumAromaticRings: | 0 |
Unique Aglycone
AD48034
Formula: C19H28O7
Smiles:
CC1C=CC(=O)OC(C)C(CO)C2OC2C=CC(=O)C(C)(O)CCC1O| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.68 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 1 |
| MolWt: | 368.43 | Num_heavy_atoms: | 26 |
| TPSA: | 116.59 | NumAromaticRings: | 0 |
