Glycoside
GD120160
Name:
10-hydroxy-8,8-dimethyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H,6H,7H,8H-pyrano[3,2-g]chromen-2-oneFormula:
C20H24O10Smiles:
CC1(C)Oc2c(cc3ccc(=O)oc3c2O)CC1OC1OC(CO)C(O)C(O)C1OAglycone:
CC1(C)Oc2c(cc3ccc(=O)oc3c2O)CC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 3 |
| MolWt: | 424.4 | Num_heavy_atoms: | 30 |
| TPSA: | 159.05 | NumAromaticRings: | 2 |
Unique Aglycone
AD48235
Formula: C14H14O5
Smiles:
CC1(C)Oc2c(cc3ccc(=O)oc3c2O)CC1O| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 1.57 | Num_rotatable_bonds: | 0 |
| MolWt: | 262.26 | Num_heavy_atoms: | 19 |
| TPSA: | 79.9 | NumAromaticRings: | 2 |
