Glycoside
GD032587
Name:
NoneFormula:
C16H23O5N3SSmiles:
CC[C@@H]1O[C@H](NC(=S)NN=Cc2ccc(OC)cc2)[C@H](O)[C@H](O)[C@H]1OAglycone:
COc1ccc(C=NNC(N)=S)cc1Sugarmoiety:
CCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 5 |
| MolWt: | 369.44 | Num_heavy_atoms: | 25 |
| TPSA: | 115.57 | NumAromaticRings: | 1 |
Unique Aglycone
AD02175
Formula: C9H11ON3S
Smiles:
COc1ccc(C=NNC(N)=S)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.11 |
| AlogP: | 0.86 | Num_rotatable_bonds: | 3 |
| MolWt: | 209.27 | Num_heavy_atoms: | 14 |
| TPSA: | 59.64 | NumAromaticRings: | 1 |
