Glycoside
GD141616
Name:
2-({12-hydroxy-2-oxatricyclo[13.2.2.1³,â·]icosa-1(17),3(20),4,6,15,18-hexaen-5-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C25H32O8Smiles:
OCC1OC(Oc2cc3cc(c2)Oc2ccc(cc2)CCC(O)CCCC3)C(O)C(O)C1OAglycone:
Oc1cc2cc(c1)Oc1ccc(cc1)CCC(O)CCCC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.52 |
| AlogP: | 1.68 | Num_rotatable_bonds: | 3 |
| MolWt: | 460.52 | Num_heavy_atoms: | 33 |
| TPSA: | 128.84 | NumAromaticRings: | 2 |
Unique Aglycone
AD57041
Formula: C19H22O3
Smiles:
Oc1cc2cc(c1)Oc1ccc(cc1)CCC(O)CCCC2| HBA: | 3 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.37 |
| AlogP: | 4.2 | Num_rotatable_bonds: | 0 |
| MolWt: | 298.38 | Num_heavy_atoms: | 22 |
| TPSA: | 49.69 | NumAromaticRings: | 2 |
