Glycoside
GD004923
Name:
NoneFormula:
C24H40O7N4SSmiles:
CCCCCCCCCC(=O)N[C@H](CCSC)C(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)n1Aglycone:
CCCCCCCCCC(=O)NC(CCSC)C(=O)Nc1cc[nH]c(=O)n1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.75 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 16 |
| MolWt: | 528.67 | Num_heavy_atoms: | 36 |
| TPSA: | 163.01 | NumAromaticRings: | 1 |
Unique Aglycone
AD04240
Formula: C19H32O3N4S
Smiles:
CCCCCCCCCC(=O)NC(CCSC)C(=O)Nc1cc[nH]c(=O)n1| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.68 |
| AlogP: | 3.09 | Num_rotatable_bonds: | 14 |
| MolWt: | 396.56 | Num_heavy_atoms: | 27 |
| TPSA: | 103.95 | NumAromaticRings: | 1 |
