Glycoside
GD066052
Name:
NoneFormula:
C13H24O8N2SSmiles:
O=C(NCCCN1CCS(=O)(=O)CC1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
NCCCN1CCS(=O)(=O)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.85 |
| AlogP: | -4.13 | Num_rotatable_bonds: | 9 |
| MolWt: | 368.41 | Num_heavy_atoms: | 24 |
| TPSA: | 164.47 | NumAromaticRings: | 0 |
Unique Aglycone
AD31722
Formula: C7H16O2N2S
Smiles:
NCCCN1CCS(=O)(=O)CC1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 3 |
| MolWt: | 192.28 | Num_heavy_atoms: | 12 |
| TPSA: | 63.4 | NumAromaticRings: | 0 |
