Glycoside
GD106931
Name:
NoneFormula:
C24H28O12N2Smiles:
CC(=O)O[C@H](C(=O)NCc1ccco1)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)C(=O)NCc1ccco1Aglycone:
NCc1ccco1.NCc1ccco1Sugarmoiety:
CC(=O)OC(C(=O)O)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(=O)OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 0.53 | Num_rotatable_bonds: | 13 |
| MolWt: | 536.49 | Num_heavy_atoms: | 38 |
| TPSA: | 189.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD12423
Formula: C5H7ON
Smiles:
NCc1ccco1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 1 |
| MolWt: | 97.12 | Num_heavy_atoms: | 7 |
| TPSA: | 39.16 | NumAromaticRings: | 1 |
