Glycoside
GD033264
Name:
NoneFormula:
C40H81O10NSSmiles:
CCCCCCCCCCCCCCCCS(=O)(=O)N[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCS(=O)(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | 6.39 | Num_rotatable_bonds: | 36 |
| MolWt: | 768.15 | Num_heavy_atoms: | 52 |
| TPSA: | 186.01 | NumAromaticRings: | 0 |
Unique Aglycone
AD21246
Formula: C34H71O5NS
Smiles:
CCCCCCCCCCCCCCCCS(=O)(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC| HBA: | 6 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | 8.56 | Num_rotatable_bonds: | 33 |
| MolWt: | 606.01 | Num_heavy_atoms: | 41 |
| TPSA: | 106.86 | NumAromaticRings: | 0 |
