Glycoside
GD102457
Name:
NoneFormula:
C25H33O9NSmiles:
COc1cc(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)ccc1OCCOCc1ccccc1Aglycone:
COc1cc(C(=O)NCCO)ccc1OCCOCc1ccccc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.48 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 12 |
| MolWt: | 491.54 | Num_heavy_atoms: | 35 |
| TPSA: | 135.94 | NumAromaticRings: | 2 |
Unique Aglycone
AD43368
Formula: C19H23O5N
Smiles:
COc1cc(C(=O)NCCO)ccc1OCCOCc1ccccc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.32 |
| AlogP: | 2.01 | Num_rotatable_bonds: | 10 |
| MolWt: | 345.4 | Num_heavy_atoms: | 25 |
| TPSA: | 77.02 | NumAromaticRings: | 2 |
