Glycoside
GD126220
Name:
2,6-dihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-3-en-1-yl 3-(3,4-dihydroxyphenyl)prop-2-enoateFormula:
C21H26O12Smiles:
O=C(C=Cc1ccc(O)c(O)c1)OC1C(O)C=CC(OC2OC(CO)C(O)C(O)C2O)C1OAglycone:
O=C(C=Cc1ccc(O)c(O)c1)OC1C(O)C=CC(O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.48 |
| AlogP: | -2.5 | Num_rotatable_bonds: | 6 |
| MolWt: | 470.43 | Num_heavy_atoms: | 33 |
| TPSA: | 206.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD51057
Formula: C15H16O7
Smiles:
O=C(C=Cc1ccc(O)c(O)c1)OC1C(O)C=CC(O)C1O| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.27 |
| AlogP: | -0.32 | Num_rotatable_bonds: | 3 |
| MolWt: | 308.29 | Num_heavy_atoms: | 22 |
| TPSA: | 127.45 | NumAromaticRings: | 1 |
