Glycoside
GD129634
Name:
5-hydroxy-2-phenyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-(3,4,5-trihydroxy-6-methyloxan-2-yl)-4H-chromen-4-oneFormula:
C27H30O13Smiles:
CC1OC(c2c(OC3OC(CO)C(O)C(O)C3O)cc3oc(-c4ccccc4)cc(=O)c3c2O)C(O)C(O)C1OAglycone:
O=c1cc(-c2ccccc2)oc2cc(O)cc(O)c12Sugarmoiety:
CC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.44 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 5 |
| MolWt: | 562.52 | Num_heavy_atoms: | 40 |
| TPSA: | 219.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD21411
Formula: C15H10O4
Smiles:
O=c1cc(-c2ccccc2)oc2cc(O)cc(O)c12| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 254.24 | Num_heavy_atoms: | 19 |
| TPSA: | 70.67 | NumAromaticRings: | 3 |
