Glycoside
GD006887
Name:
NoneFormula:
C18H21O9N3SSmiles:
CSc1nc(NC2OCC(OC(C)=O)C(OC(C)=O)C2OC(C)=O)c2c(n1)OCC2=OAglycone:
CSc1nc(N)c2c(n1)OCC2=OSugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.56 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 6 |
| MolWt: | 455.45 | Num_heavy_atoms: | 31 |
| TPSA: | 152.24 | NumAromaticRings: | 1 |
Unique Aglycone
AD05651
Formula: C7H7O2N3S
Smiles:
CSc1nc(N)c2c(n1)OCC2=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 1 |
| MolWt: | 197.22 | Num_heavy_atoms: | 13 |
| TPSA: | 78.1 | NumAromaticRings: | 1 |
