Glycoside

GD034807
Name:
NoneFormula:
C30H40O9Smiles:
CCCCCCCC(=O)OC[C@@H]1O[C@H](Oc2cc(C=Cc3ccc(OC)cc3)cc(OC)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
CCCCCCCC(=O)OC.COc1ccc(C=Cc2cc(O)cc(OC)c2)cc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 9 | RingCount: | 3 |
HBD: | 3 | FractionCSP3: | 0.5 |
AlogP: | 3.96 | Num_rotatable_bonds: | 14 |
MolWt: | 544.64 | Num_heavy_atoms: | 39 |
TPSA: | 123.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD01605
Formula: C9H18O2
Smiles:
CCCCCCCC(=O)OCHBA: | 2 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 0.89 |
AlogP: | 2.52 | Num_rotatable_bonds: | 6 |
MolWt: | 158.24 | Num_heavy_atoms: | 11 |
TPSA: | 26.3 | NumAromaticRings: | 0 |
AD22084
Formula: C16H16O3
Smiles:
COc1ccc(C=Cc2cc(O)cc(OC)c2)cc1HBA: | 3 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.12 |
AlogP: | 3.58 | Num_rotatable_bonds: | 4 |
MolWt: | 256.3 | Num_heavy_atoms: | 19 |
TPSA: | 38.69 | NumAromaticRings: | 2 |