Glycoside
GD097407
Name:
NoneFormula:
C20H27O6N5SSmiles:
Cc1ccc(N2CCCc3sc(C(=O)NCCO[C@@H]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]4O)nc32)nn1Aglycone:
Cc1ccc(N2CCCc3sc(C(=O)NCCO)nc32)nn1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -0.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 465.53 | Num_heavy_atoms: | 32 |
| TPSA: | 150.16 | NumAromaticRings: | 2 |
Unique Aglycone
AD41422
Formula: C14H17O2N5S
Smiles:
Cc1ccc(N2CCCc3sc(C(=O)NCCO)nc32)nn1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 1.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 319.39 | Num_heavy_atoms: | 22 |
| TPSA: | 91.24 | NumAromaticRings: | 2 |
