Glycoside
GD117770
Name:
5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-7-yl 3-(4-hydroxyphenyl)prop-2-enoateFormula:
C30H26O13Smiles:
O=C(C=Cc1ccc(O)cc1)Oc1cc(O)c2c(=O)c(OC3OC(CO)C(O)C(O)C3O)c(-c3ccc(O)cc3)oc2c1Aglycone:
O=C(C=Cc1ccc(O)cc1)Oc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.2 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 7 |
| MolWt: | 594.53 | Num_heavy_atoms: | 43 |
| TPSA: | 216.58 | NumAromaticRings: | 4 |
Unique Aglycone
AD44961
Formula: C24H16O8
Smiles:
O=C(C=Cc1ccc(O)cc1)Oc1cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc2c1| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 3.9 | Num_rotatable_bonds: | 4 |
| MolWt: | 432.38 | Num_heavy_atoms: | 32 |
| TPSA: | 137.43 | NumAromaticRings: | 4 |
