Glycoside
GD142220
Name:
16-ethyl-6,15-dihydroxy-15-{[(5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl)oxy]methyl}-5,7,9-trimethyl-1-oxacyclohexadeca-3,11,13-triene-2,10-dioneFormula:
C29H46O10Smiles:
CCC1OC(=O)C=CC(C)C(O)C(C)CC(C)C(=O)C=CC=CC1(O)COC1OC(C)C(O)C(OC)C1OCAglycone:
CCC1OC(=O)C=CC(C)C(O)C(C)CC(C)C(=O)C=CC=CC1(O)COSugarmoiety:
COC1C(O)OC(C)C(O)C1OCOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.72 |
| AlogP: | 2.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 554.68 | Num_heavy_atoms: | 39 |
| TPSA: | 140.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD57240
Formula: C21H32O6
Smiles:
CCC1OC(=O)C=CC(C)C(O)C(C)CC(C)C(=O)C=CC=CC1(O)CO| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.62 |
| AlogP: | 1.94 | Num_rotatable_bonds: | 2 |
| MolWt: | 380.48 | Num_heavy_atoms: | 27 |
| TPSA: | 104.06 | NumAromaticRings: | 0 |
