Glycoside

GD023131
Name:
NoneFormula:
C38H56O9Smiles:
CCCCCCCCCCCCCCCCCC(=O)OC[C@@H]1O[C@H](Oc2cc(O)cc(C=Cc3ccc(O)cc3)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
CCCCCCCCCCCCCCCCCC(=O)OC.Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 9 | RingCount: | 3 |
HBD: | 5 | FractionCSP3: | 0.61 |
AlogP: | 7.26 | Num_rotatable_bonds: | 22 |
MolWt: | 656.86 | Num_heavy_atoms: | 47 |
TPSA: | 145.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD01773
Formula: C14H12O3
Smiles:
Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1HBA: | 3 | RingCount: | 2 |
HBD: | 3 | FractionCSP3: | 0.0 |
AlogP: | 2.97 | Num_rotatable_bonds: | 2 |
MolWt: | 228.25 | Num_heavy_atoms: | 17 |
TPSA: | 60.69 | NumAromaticRings: | 2 |
AD02574
Formula: C19H38O2
Smiles:
CCCCCCCCCCCCCCCCCC(=O)OCHBA: | 2 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 0.95 |
AlogP: | 6.42 | Num_rotatable_bonds: | 16 |
MolWt: | 298.51 | Num_heavy_atoms: | 21 |
TPSA: | 26.3 | NumAromaticRings: | 0 |