Glycoside
GD150192
Name:
Dichotomoside DFormula:
C34H48O13Smiles:
CCCCOC(=O)CCc1cc(OC)c(O)c(-c2cc(CCC(=O)OCCCC)cc(OC)c2OC2OC(CO)C(O)C(O)C2O)c1Aglycone:
CCCCOC(=O)CCc1cc(OC)c(O)c(-c2cc(CCC(=O)OCCCC)cc(OC)c2O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | 2.81 | Num_rotatable_bonds: | 18 |
| MolWt: | 664.75 | Num_heavy_atoms: | 47 |
| TPSA: | 190.67 | NumAromaticRings: | 2 |
Unique Aglycone
AD60009
Formula: C28H38O8
Smiles:
CCCCOC(=O)CCc1cc(OC)c(O)c(-c2cc(CCC(=O)OCCCC)cc(OC)c2O)c1| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 5.33 | Num_rotatable_bonds: | 15 |
| MolWt: | 502.6 | Num_heavy_atoms: | 36 |
| TPSA: | 111.52 | NumAromaticRings: | 2 |
