Glycoside
GD033307
Name:
NoneFormula:
C32H39O10NSmiles:
CC(C)(C)c1ccc(Oc2ccc(NC(=O)C3=CO[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@@H]4C(CO)=CC[C@H]34)cc2)cc1Aglycone:
CC(C)(C)c1ccc(Oc2ccc(NC(=O)C3=COC(O)C4C(CO)=CCC34)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.47 |
| AlogP: | 2.33 | Num_rotatable_bonds: | 8 |
| MolWt: | 597.66 | Num_heavy_atoms: | 43 |
| TPSA: | 167.17 | NumAromaticRings: | 2 |
Unique Aglycone
AD21274
Formula: C26H29O5N
Smiles:
CC(C)(C)c1ccc(Oc2ccc(NC(=O)C3=COC(O)C4C(CO)=CCC34)cc2)cc1| HBA: | 6 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.35 |
| AlogP: | 4.5 | Num_rotatable_bonds: | 5 |
| MolWt: | 435.52 | Num_heavy_atoms: | 32 |
| TPSA: | 88.02 | NumAromaticRings: | 2 |
