Glycoside
GD151167
Name:
2-Methylthio-N6-(Delta2-Isopentenyl)AdenosineFormula:
C16H23O4N5SSmiles:
CSc1nc(NCC=C(C)C)c2ncn(C3OC(CO)C(O)C3O)c2n1Aglycone:
CSc1nc2c(c(NCC=C(C)C)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 6 |
| MolWt: | 381.46 | Num_heavy_atoms: | 26 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD24492
Formula: C11H14N5S
Smiles:
CSc1nc2c(c(NCC=C(C)C)n1)N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 2.49 | Num_rotatable_bonds: | 4 |
| MolWt: | 248.34 | Num_heavy_atoms: | 17 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
