Glycoside
GD137042
Name:
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-{[4-(4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-yl]oxy}oxane-3,4,5-triolFormula:
C24H40O11Smiles:
CC1=CC(O)CC(C)(C)C1C=CC(C)OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1OAglycone:
CC1=CC(O)CC(C)(C)C1C=CC(C)OSugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.83 |
| AlogP: | -1.43 | Num_rotatable_bonds: | 8 |
| MolWt: | 504.57 | Num_heavy_atoms: | 35 |
| TPSA: | 178.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD55384
Formula: C13H22O2
Smiles:
CC1=CC(O)CC(C)(C)C1C=CC(C)O| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.69 |
| AlogP: | 2.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 210.32 | Num_heavy_atoms: | 15 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
