Glycoside
GD037765
Name:
n-({(2z)-2-[(4-hydroxyphenyl)methylidene]hydrazino}carbonothioyl)-beta-d-glucopyranosylamineFormula:
C14H19O6N3SSmiles:
OC[C@H]1O[C@H](NC(=S)NN=Cc2ccc(O)cc2)[C@@H](O)[C@@H](O)[C@H]1OAglycone:
NC(=S)NN=Cc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.43 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 357.39 | Num_heavy_atoms: | 24 |
| TPSA: | 146.8 | NumAromaticRings: | 1 |
Unique Aglycone
AD02163
Formula: C8H9ON3S
Smiles:
NC(=S)NN=Cc1ccc(O)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 2 |
| MolWt: | 195.25 | Num_heavy_atoms: | 13 |
| TPSA: | 70.64 | NumAromaticRings: | 1 |
