Glycoside
GD092125
Name:
NoneFormula:
C16H26O3N7S2Smiles:
CSC[C@H]1O[C@@H](n2cnc3c(NC(=S)NCC[NH+](C)C)ncnc32)[C@H](O)[C@@H]1OAglycone:
C[NH+](C)CCNC(=S)Nc1ncnc2c1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.76 | Num_rotatable_bonds: | 7 |
| MolWt: | 428.56 | Num_heavy_atoms: | 28 |
| TPSA: | 121.79 | NumAromaticRings: | 2 |
Unique Aglycone
AD35072
Formula: C10H15N7S
Smiles:
C[NH+](C)CCNC(=S)Nc1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | -1.18 | Num_rotatable_bonds: | 4 |
| MolWt: | 265.35 | Num_heavy_atoms: | 18 |
| TPSA: | 80.74 | NumAromaticRings: | 1 |
