Glycoside
GD116488
Name:
NoneFormula:
C30H40O12Smiles:
C=C(C(=O)O)C1CC(OC2OC(COC(=O)C=Cc3ccc(O)c(O)c3)C(O)C(O)C2O)C2(C)CCCC(C)(O)C2C1Aglycone:
C=C(C(=O)O)C1CC(O)C2(C)CCCC(C)(O)C2C1.COC(=O)C=Cc1ccc(O)c(O)c1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.6 |
| AlogP: | 1.46 | Num_rotatable_bonds: | 8 |
| MolWt: | 592.64 | Num_heavy_atoms: | 42 |
| TPSA: | 203.44 | NumAromaticRings: | 1 |
Unique Aglycone
AD03431
Formula: C10H10O4
Smiles:
COC(=O)C=Cc1ccc(O)c(O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 1.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 194.19 | Num_heavy_atoms: | 14 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
AD46262
Formula: C15H24O4
Smiles:
C=C(C(=O)O)C1CC(O)C2(C)CCCC(C)(O)C2C1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 2 |
| MolWt: | 268.35 | Num_heavy_atoms: | 19 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
