Glycoside
GD057655
Name:
NoneFormula:
C13H21O6N3SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2c[nH]c(=S)n2C)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
Cn1c(C(=O)NCCO)c[nH]c1=SSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -1.34 | Num_rotatable_bonds: | 5 |
| MolWt: | 347.39 | Num_heavy_atoms: | 23 |
| TPSA: | 128.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD28928
Formula: C7H11O2N3S
Smiles:
Cn1c(C(=O)NCCO)c[nH]c1=S| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 201.25 | Num_heavy_atoms: | 13 |
| TPSA: | 70.05 | NumAromaticRings: | 1 |
