Glycoside
GD026267
Name:
NoneFormula:
C33H56O7SSmiles:
CC(O)C1CCC2C3CC=C4CC(OCCCCCCSC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12CAglycone:
CC(O)C1CCC2C3CC=C4CC(OCCCCCCS)CCC4(C)C3CCC12CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | 4.42 | Num_rotatable_bonds: | 11 |
| MolWt: | 596.87 | Num_heavy_atoms: | 41 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD17325
Formula: C27H46O2S
Smiles:
CC(O)C1CCC2C3CC=C4CC(OCCCCCCS)CCC4(C)C3CCC12C| HBA: | 2 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.93 |
| AlogP: | 6.82 | Num_rotatable_bonds: | 8 |
| MolWt: | 434.73 | Num_heavy_atoms: | 30 |
| TPSA: | 29.46 | NumAromaticRings: | 0 |
