Glycoside
GD002773
Name:
NoneFormula:
C39H69O5NSSmiles:
CC(C)CCCC(C)C1CCC2C3CC=C4CC(OCCCCCCSC5OC(CN)C(O)C(O)C5O)CCC4(C)C3CCC12CAglycone:
CC(C)CCCC(C)C1CCC2C3CC=C4CC(OCCCCCCS)CCC4(C)C3CCC12CSugarmoiety:
NCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.95 |
| AlogP: | 7.47 | Num_rotatable_bonds: | 15 |
| MolWt: | 664.05 | Num_heavy_atoms: | 46 |
| TPSA: | 105.17 | NumAromaticRings: | 0 |
Unique Aglycone
AD01621
Formula: C33H58OS
Smiles:
CC(C)CCCC(C)C1CCC2C3CC=C4CC(OCCCCCCS)CCC4(C)C3CCC12C| HBA: | 1 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.94 |
| AlogP: | 9.9 | Num_rotatable_bonds: | 12 |
| MolWt: | 502.89 | Num_heavy_atoms: | 35 |
| TPSA: | 9.23 | NumAromaticRings: | 0 |
