Glycoside
GD018877
Name:
NoneFormula:
C29H31O8N5SSmiles:
COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2c1[nH]c1ccc(NC3OC(CO)C(O)C(O)C3O)cc12Aglycone:
COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2c1[nH]c1ccc(N)cc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 0.28 |
| AlogP: | 2.2 | Num_rotatable_bonds: | 8 |
| MolWt: | 609.66 | Num_heavy_atoms: | 43 |
| TPSA: | 198.29 | NumAromaticRings: | 5 |
Unique Aglycone
AD13234
Formula: C23H21O3N5S
Smiles:
COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2c1[nH]c1ccc(N)cc12| HBA: | 8 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.09 |
| AlogP: | 4.58 | Num_rotatable_bonds: | 5 |
| MolWt: | 447.52 | Num_heavy_atoms: | 32 |
| TPSA: | 122.13 | NumAromaticRings: | 5 |
