Glycoside
GD152176
Name:
2-[(6-{[4,5-dihydroxy-6-({10,14,16,20-tetramethyl-22-azahexacyclo[12.10.0.0²,¹¹.0âµ,¹â°.0¹âµ,²³.0¹â·,²²]tetracos-4-en-7-yl}oxy)oxan-3-yl]oxy}-4,5-dihydroxyoxan-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C43H69O14NSmiles:
CC1CCC2C(C)C3C(CC4C5CC=C6CC(OC7OCC(OC8OCC(OC9OC(CO)C(O)C(O)C9O)C(O)C8O)C(O)C7O)CCC6(C)C5CCC43C)N2C1Aglycone:
CC1CCC2C(C)C3C(CC4C5CC=C6CC(O)CCC6(C)C5CCC43C)N2C1Sugarmoiety:
OCC1OC(OC2COC(OC3COC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 9 |
| HBD: | 8 | FractionCSP3: | 0.95 |
| AlogP: | 0.41 | Num_rotatable_bonds: | 7 |
| MolWt: | 824.02 | Num_heavy_atoms: | 58 |
| TPSA: | 220.46 | NumAromaticRings: | 0 |
Unique Aglycone
AD08056
Formula: C27H43ON
Smiles:
CC1CCC2C(C)C3C(CC4C5CC=C6CC(O)CCC6(C)C5CCC43C)N2C1| HBA: | 2 | RingCount: | 6 |
| HBD: | 1 | FractionCSP3: | 0.93 |
| AlogP: | 5.66 | Num_rotatable_bonds: | 0 |
| MolWt: | 397.65 | Num_heavy_atoms: | 29 |
| TPSA: | 23.47 | NumAromaticRings: | 0 |
