Glycoside
GD121931
Name:
7-[2-(furan-3-yl)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl]-7,8-dimethyl-1H,3H,5H,6H,6aH,7H,8H,9H,10H-naphtho[1,8a-c]furan-3-oneFormula:
C26H36O9Smiles:
CC1CCC23COC(=O)C2=CCCC3C1(C)CC(OC1OC(CO)C(O)C(O)C1O)c1ccoc1Aglycone:
CC1CCC23COC(=O)C2=CCCC3C1(C)CC(O)c1ccoc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 6 |
| MolWt: | 492.57 | Num_heavy_atoms: | 35 |
| TPSA: | 138.82 | NumAromaticRings: | 1 |
Unique Aglycone
AD49108
Formula: C20H26O4
Smiles:
CC1CCC23COC(=O)C2=CCCC3C1(C)CC(O)c1ccoc1| HBA: | 4 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.65 |
| AlogP: | 4.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.42 | Num_heavy_atoms: | 24 |
| TPSA: | 59.67 | NumAromaticRings: | 1 |
