Glycoside
GD026941
Name:
Carnemycin BFormula:
C23H32O9Smiles:
CCCC=CC=CCCc1cc(O)c([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(O)c1C(=O)OCAglycone:
CCCC=CC=CCCc1cc(O)cc(O)c1C(=O)OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.52 |
| AlogP: | 1.24 | Num_rotatable_bonds: | 9 |
| MolWt: | 452.5 | Num_heavy_atoms: | 32 |
| TPSA: | 156.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD17734
Formula: C17H22O4
Smiles:
CCCC=CC=CCCc1cc(O)cc(O)c1C(=O)OC| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.35 |
| AlogP: | 3.73 | Num_rotatable_bonds: | 7 |
| MolWt: | 290.36 | Num_heavy_atoms: | 21 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
