Glycoside
GD026782
Name:
NoneFormula:
C23H39O8N7SSmiles:
CCN(CC)C(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:
CCN(CC)C(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: | 0.74 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 13 |
| MolWt: | 573.67 | Num_heavy_atoms: | 39 |
| TPSA: | 218.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD17640
Formula: C17H29O4N7S
Smiles:
CCN(CC)C(CCO)=NS(=O)(=O)CCCCCn1cnc2c(=O)[nH]c(N)nc21| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 11 |
| MolWt: | 427.53 | Num_heavy_atoms: | 29 |
| TPSA: | 159.56 | NumAromaticRings: | 2 |
