Glycoside
GD134517
Name:
GilvocarcinFormula:
C27H28O9Smiles:
CCc1cc(OC)c2c(c1)c(=O)oc1c2cc(OC)c2c(O)ccc(C3OC(C(C)O)C(O)C3O)c21Aglycone:
CCc1cc(OC)c2c(c1)c(=O)oc1c3cccc(O)c3c(OC)cc12Sugarmoiety:
CC(O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 2.93 | Num_rotatable_bonds: | 5 |
| MolWt: | 496.51 | Num_heavy_atoms: | 36 |
| TPSA: | 138.82 | NumAromaticRings: | 4 |
Unique Aglycone
AD54415
Formula: C21H18O5
Smiles:
CCc1cc(OC)c2c(c1)c(=O)oc1c3cccc(O)c3c(OC)cc12| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.19 |
| AlogP: | 4.38 | Num_rotatable_bonds: | 3 |
| MolWt: | 350.37 | Num_heavy_atoms: | 26 |
| TPSA: | 68.9 | NumAromaticRings: | 4 |
