Glycoside
GD101894
Name:
NoneFormula:
C23H27O7N3Smiles:
COc1ccc2cc(-c3cc(C(=O)NCCO[C@@H]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]4O)[nH]n3)ccc2c1Aglycone:
COc1ccc2cc(-c3cc(C(=O)NCCO)[nH]n3)ccc2c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 7 |
| MolWt: | 457.48 | Num_heavy_atoms: | 33 |
| TPSA: | 146.16 | NumAromaticRings: | 3 |
Unique Aglycone
AD43141
Formula: C17H17O3N3
Smiles:
COc1ccc2cc(-c3cc(C(=O)NCCO)[nH]n3)ccc2c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.18 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 5 |
| MolWt: | 311.34 | Num_heavy_atoms: | 23 |
| TPSA: | 87.24 | NumAromaticRings: | 3 |
