Glycoside
GD037693
Name:
n-({(2e)-2-[(4-methylphenyl)methylidene]hydrazino}carbonothioyl)-beta-d-glucopyranosylamineFormula:
C15H21O5N3SSmiles:
Cc1ccc(C=NNC(=S)N[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc1Aglycone:
Cc1ccc(C=NNC(N)=S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.47 |
| AlogP: | -1.41 | Num_rotatable_bonds: | 4 |
| MolWt: | 355.42 | Num_heavy_atoms: | 24 |
| TPSA: | 126.57 | NumAromaticRings: | 1 |
Unique Aglycone
AD15565
Formula: C9H11N3S
Smiles:
Cc1ccc(C=NNC(N)=S)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.11 |
| AlogP: | 1.16 | Num_rotatable_bonds: | 2 |
| MolWt: | 193.28 | Num_heavy_atoms: | 13 |
| TPSA: | 50.41 | NumAromaticRings: | 1 |
