Glycoside
GD016664
Name:
NoneFormula:
C37H62O8SSmiles:
CC(C)CCOC(=O)C1CCC2C3CC=C4CC(OCCCCCCSC5OC(CO)C(O)C(O)C5O)CCC4(C)C3CCC12CAglycone:
CC(C)CCOC(=O)C1CCC2C3CC=C4CC(OCCCCCCS)CCC4(C)C3CCC12CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.92 |
| AlogP: | 5.63 | Num_rotatable_bonds: | 14 |
| MolWt: | 666.96 | Num_heavy_atoms: | 46 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD11967
Formula: C31H52O3S
Smiles:
CC(C)CCOC(=O)C1CCC2C3CC=C4CC(OCCCCCCS)CCC4(C)C3CCC12C| HBA: | 3 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.9 |
| AlogP: | 8.03 | Num_rotatable_bonds: | 11 |
| MolWt: | 504.82 | Num_heavy_atoms: | 35 |
| TPSA: | 35.53 | NumAromaticRings: | 0 |
