Glycoside

GD156860
Name:
Dracunculifoside CFormula:
C24H26O12Smiles:
O=C(O)CCc1ccc(OC2OC(COC(=O)C=Cc3ccc(O)c(O)c3)C(O)C(O)C2O)c(O)c1Aglycone:
COC(=O)C=Cc1ccc(O)c(O)c1.O=C(O)CCc1ccc(O)c(O)c1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 12 | RingCount: | 3 |
HBD: | 7 | FractionCSP3: | 0.33 |
AlogP: | 0.26 | Num_rotatable_bonds: | 9 |
MolWt: | 506.46 | Num_heavy_atoms: | 36 |
TPSA: | 203.44 | NumAromaticRings: | 2 |
Unique Aglycone
AD03431
Formula: C10H10O4
Smiles:
COC(=O)C=Cc1ccc(O)c(O)c1HBA: | 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 |
AD45057
Formula: C9H10O4
Smiles:
O=C(O)CCc1ccc(O)c(O)c1HBA: | 4 | RingCount: | 1 |
HBD: | 3 | FractionCSP3: | 0.22 |
AlogP: | 1.11 | Num_rotatable_bonds: | 3 |
MolWt: | 182.18 | Num_heavy_atoms: | 13 |
TPSA: | 77.76 | NumAromaticRings: | 1 |