Glycoside
GD069205
Name:
NoneFormula:
C14H19O6N3SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cc3n[nH]cc3s2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1cc2n[nH]cc2s1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -0.8 | Num_rotatable_bonds: | 5 |
| MolWt: | 357.39 | Num_heavy_atoms: | 24 |
| TPSA: | 136.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD32832
Formula: C8H9O2N3S
Smiles:
O=C(NCCO)c1cc2n[nH]cc2s1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 3 |
| MolWt: | 211.25 | Num_heavy_atoms: | 14 |
| TPSA: | 78.01 | NumAromaticRings: | 2 |
