Glycoside
GD018369
Name:
NoneFormula:
C41H70O6SSmiles:
CCC(C=CC(C)C1CCC2C3CC=C4CC(OCCCCCCSC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12C)C(C)CAglycone:
CCC(C=CC(C)C1CCC2C3CC=C4CC(OCCCCCCS)CCC4(C)C3CCC12C)C(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | 7.92 | Num_rotatable_bonds: | 15 |
| MolWt: | 691.07 | Num_heavy_atoms: | 48 |
| TPSA: | 99.38 | NumAromaticRings: | 0 |
Unique Aglycone
AD12972
Formula: C35H60OS
Smiles:
CCC(C=CC(C)C1CCC2C3CC=C4CC(OCCCCCCS)CCC4(C)C3CCC12C)C(C)C| HBA: | 1 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.89 |
| AlogP: | 10.32 | Num_rotatable_bonds: | 12 |
| MolWt: | 528.93 | Num_heavy_atoms: | 37 |
| TPSA: | 9.23 | NumAromaticRings: | 0 |
