Glycoside
GD003248
Name:
NoneFormula:
C16H20O6N4SSmiles:
Cc1cccc2c1c(N=NC(=N)S)c(O)n2C1OC(CO)C(O)C(O)C1OAglycone:
Cc1cccc2[nH]c(O)c(N=NC(=N)S)c12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.44 |
| AlogP: | 0.58 | Num_rotatable_bonds: | 3 |
| MolWt: | 396.43 | Num_heavy_atoms: | 27 |
| TPSA: | 163.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD02959
Formula: C10H10ON4S
Smiles:
Cc1cccc2[nH]c(O)c(N=NC(=N)S)c12| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.1 |
| AlogP: | 3.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 234.28 | Num_heavy_atoms: | 16 |
| TPSA: | 84.59 | NumAromaticRings: | 2 |
