Glycoside
GD143607
Name:
5,5,9-trimethyl-14-methylidene-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}tetracyclo[11.2.1.0¹,¹â°.0â´,â¹]hexadecane-2,12,15,16-tetrolFormula:
C26H42O10Smiles:
C=C1C2C(O)CC3C4(C)C(OC5OC(CO)C(O)C(O)C5O)CCC(C)(C)C4CC(O)C3(C1O)C2OAglycone:
C=C1C2C(O)CC3C4(C)C(O)CCC(C)(C)C4CC(O)C3(C1O)C2OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.92 |
| AlogP: | -1.35 | Num_rotatable_bonds: | 3 |
| MolWt: | 514.61 | Num_heavy_atoms: | 36 |
| TPSA: | 180.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD57750
Formula: C20H32O5
Smiles:
C=C1C2C(O)CC3C4(C)C(O)CCC(C)(C)C4CC(O)C3(C1O)C2O| HBA: | 5 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.9 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 0 |
| MolWt: | 352.47 | Num_heavy_atoms: | 25 |
| TPSA: | 101.15 | NumAromaticRings: | 0 |
