Glycoside
GD095383
Name:
NoneFormula:
C20H26O8N4SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ncn3c2CN(C)S(=O)(=O)c2ccccc2-3)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CN1Cc2c(C(=O)NCCO)ncn2-c2ccccc2S1(=O)=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 5 |
| MolWt: | 482.52 | Num_heavy_atoms: | 33 |
| TPSA: | 163.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD40712
Formula: C14H16O4N4S
Smiles:
CN1Cc2c(C(=O)NCCO)ncn2-c2ccccc2S1(=O)=O| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 336.37 | Num_heavy_atoms: | 23 |
| TPSA: | 104.53 | NumAromaticRings: | 2 |
