Glycoside
GD066998
Name:
NoneFormula:
C14H29O7N2SSmiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)CC2CC[NH2+]CC2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=S(=O)(CC1CC[NH2+]CC1)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -3.28 | Num_rotatable_bonds: | 7 |
| MolWt: | 369.46 | Num_heavy_atoms: | 24 |
| TPSA: | 141.93 | NumAromaticRings: | 0 |
Unique Aglycone
AD32025
Formula: C8H19O3N2S
Smiles:
O=S(=O)(CC1CC[NH2+]CC1)NCCO| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -2.13 | Num_rotatable_bonds: | 5 |
| MolWt: | 223.32 | Num_heavy_atoms: | 14 |
| TPSA: | 83.01 | NumAromaticRings: | 0 |
