Glycoside
GD037137
Name:
NoneFormula:
C20H32O9N6SSmiles:
COC(CCO[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1O)=NS(=O)(=O)CCCCCn1cnc2c(=O)[nH]c(N)nc21Aglycone:
COC(CCO)=NS(=O)(=O)CCCCCn1cnc2c(=O)[nH]c(N)nc21Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.7 |
| AlogP: | -1.52 | Num_rotatable_bonds: | 11 |
| MolWt: | 532.58 | Num_heavy_atoms: | 36 |
| TPSA: | 224.47 | NumAromaticRings: | 2 |
Unique Aglycone
AD23416
Formula: C14H22O5N6S
Smiles:
COC(CCO)=NS(=O)(=O)CCCCCn1cnc2c(=O)[nH]c(N)nc21| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 9 |
| MolWt: | 386.43 | Num_heavy_atoms: | 26 |
| TPSA: | 165.55 | NumAromaticRings: | 2 |
