Glycoside
GD154794
Name:
2-{[22-(2-methoxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.0¹,¹â¸.0³,¹â·.0â´,¹â´.0â·,¹².0¹²,¹â´]tetracosan-9-yl]oxy}oxane-3,4,5-triolFormula:
C36H58O8Smiles:
COC(C)(C)C1OC23CC4(C)C5CCC6C(C)(C)C(OC7OCC(O)C(O)C7O)CCC67CC57CCC4(C)C2C(C)CC1O3Aglycone:
COC(C)(C)C1OC23CC4(C)C5CCC6C(C)(C)C(O)CCC67CC57CCC4(C)C2C(C)CC1O3Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 8 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 4.8 | Num_rotatable_bonds: | 4 |
| MolWt: | 618.85 | Num_heavy_atoms: | 44 |
| TPSA: | 106.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD61451
Formula: C31H50O4
Smiles:
COC(C)(C)C1OC23CC4(C)C5CCC6C(C)(C)C(O)CCC67CC57CCC4(C)C2C(C)CC1O3| HBA: | 4 | RingCount: | 7 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 6.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 486.74 | Num_heavy_atoms: | 35 |
| TPSA: | 47.92 | NumAromaticRings: | 0 |
