Glycoside
GD021977
Name:
ACEROSIDE IFormula:
C25H32O8Smiles:
OC[C@@H]1O[C@H](Oc2ccc3cc2Oc2ccc(cc2)CC[C@H](O)CCCC3)[C@H](O)[C@H](O)[C@H]1OAglycone:
Oc1ccc2cc1Oc1ccc(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
AD09524
Formula: C19H22O3
Smiles:
Oc1ccc2cc1Oc1ccc(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 |
