Glycoside
GD132293
Name:
2-({17-hydroxy-2-oxatricyclo[12.2.2.2³,â¶]icosa-1(16),3,5,14,17,19-hexaen-9-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C25H32O8Smiles:
OCC1OC(OC2CCCCc3ccc(c(O)c3)Oc3ccc(cc3)CC2)C(O)C(O)C1OAglycone:
Oc1cc2ccc1Oc1ccc(cc1)CCC(O)CCCC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.52 |
| AlogP: | 2.03 | Num_rotatable_bonds: | 3 |
| MolWt: | 460.52 | Num_heavy_atoms: | 33 |
| TPSA: | 128.84 | NumAromaticRings: | 2 |
Unique Aglycone
AD53556
Formula: C19H22O3
Smiles:
Oc1cc2ccc1Oc1ccc(cc1)CCC(O)CCCC2| HBA: | 3 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.37 |
| AlogP: | 4.2 | Num_rotatable_bonds: | 0 |
| MolWt: | 298.38 | Num_heavy_atoms: | 22 |
| TPSA: | 49.69 | NumAromaticRings: | 2 |
