Glycoside
GD148367
Name:
Dracunculifoside HFormula:
C27H32O13Smiles:
O=C(C=Cc1ccc(O)c(O)c1)OCC1(O)COC(OCC2OC(OCc3ccccc3)C(O)C(O)C2O)C1OAglycone:
COC(=O)C=Cc1ccc(O)c(O)c1.OCc1ccccc1Sugarmoiety:
OC1OC(COC2OCC(O)(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.44 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 10 |
| MolWt: | 564.54 | Num_heavy_atoms: | 40 |
| TPSA: | 204.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD00044
Formula: C7H8O
Smiles:
OCc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
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 |
