Glycoside
GD128055
Name:
5,5,9,14-tetramethyl-6-[(3,4,5-trihydroxyoxan-2-yl)oxy]tetracyclo[11.2.1.0¹,¹â°.0â´,â¹]hexadecan-12-oneFormula:
C25H40O6Smiles:
CC1CC23CCC4C(C)(C)C(OC5OCC(O)C(O)C5O)CCC4(C)C2CC(=O)C1C3Aglycone:
CC1CC23CCC4C(C)(C)C(O)CCC4(C)C2CC(=O)C1C3Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.96 |
| AlogP: | 2.67 | Num_rotatable_bonds: | 2 |
| MolWt: | 436.59 | Num_heavy_atoms: | 31 |
| TPSA: | 96.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD51874
Formula: C20H32O2
Smiles:
CC1CC23CCC4C(C)(C)C(O)CCC4(C)C2CC(=O)C1C3| HBA: | 2 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.95 |
| AlogP: | 4.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 304.47 | Num_heavy_atoms: | 22 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
