Glycoside
GD103480
Name:
NoneFormula:
C19H32O3N7S2Smiles:
CC[NH+](CC)CCCNC(=S)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSC)[C@@H](O)[C@H]1OAglycone:
CC[NH+](CC)CCCNC(=S)Nc1ncnc2c1N=C[N]2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.68 |
| AlogP: | -0.59 | Num_rotatable_bonds: | 10 |
| MolWt: | 470.65 | Num_heavy_atoms: | 31 |
| TPSA: | 121.79 | NumAromaticRings: | 2 |
Unique Aglycone
AD40200
Formula: C13H21N7S
Smiles:
CC[NH+](CC)CCCNC(=S)Nc1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.54 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 7 |
| MolWt: | 307.43 | Num_heavy_atoms: | 21 |
| TPSA: | 80.74 | NumAromaticRings: | 1 |
