Glycoside
GD017266
Name:
NoneFormula:
C24H34O6N5SISmiles:
Nc1nc(OCc2ccc([131I])s2)c2ncn(CCCCCCCC[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c2n1Aglycone:
CCCCCCCCn1cnc2c(OCc3ccc(I)s3)nc(N)nc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.62 |
| AlogP: | 2.23 | Num_rotatable_bonds: | 13 |
| MolWt: | 651.54 | Num_heavy_atoms: | 37 |
| TPSA: | 169.0 | NumAromaticRings: | 3 |
Unique Aglycone
AD06459
Formula: C18H24ON5SI
Smiles:
CCCCCCCCn1cnc2c(OCc3ccc(I)s3)nc(N)nc21| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 5.01 | Num_rotatable_bonds: | 10 |
| MolWt: | 485.4 | Num_heavy_atoms: | 26 |
| TPSA: | 78.85 | NumAromaticRings: | 3 |
