Glycoside
GD127335
Name:
(4-Hydroxybenzyl)Thiocarbamic Acid; 4'-O-(Tri-O-Acetyl-α-L-Rhamnopyranoside), O-Me Ester (E-)Formula:
C21H27O9NSSmiles:
COC(S)=NCc1ccc(OC2OC(C)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)cc1Aglycone:
COC(S)=NCc1ccc(O)cc1Sugarmoiety:
CC(=O)OC1C(C)OC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.52 |
| AlogP: | 2.04 | Num_rotatable_bonds: | 7 |
| MolWt: | 469.51 | Num_heavy_atoms: | 32 |
| TPSA: | 118.95 | NumAromaticRings: | 1 |
Unique Aglycone
AD50908
Formula: C9H11O2NS
Smiles:
COC(S)=NCc1ccc(O)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.22 |
| AlogP: | 1.82 | Num_rotatable_bonds: | 2 |
| MolWt: | 197.26 | Num_heavy_atoms: | 13 |
| TPSA: | 41.82 | NumAromaticRings: | 1 |
