Glycoside
GD148004
Name:
Dalmaisione AFormula:
C28H28O14Smiles:
CC1OC(OC2C(Oc3cccc4c3oc(=O)c3c(=O)c5ccccc5oc34)OC(CO)C(O)C2O)C(O)C(O)C1OAglycone:
O=c1oc2c(O)cccc2c2oc3ccccc3c(=O)c12Sugarmoiety:
CC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.43 |
| AlogP: | -0.92 | Num_rotatable_bonds: | 5 |
| MolWt: | 588.52 | Num_heavy_atoms: | 42 |
| TPSA: | 218.72 | NumAromaticRings: | 4 |
Unique Aglycone
AD46482
Formula: C16H8O5
Smiles:
O=c1oc2c(O)cccc2c2oc3ccccc3c(=O)c12| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.76 | Num_rotatable_bonds: | 0 |
| MolWt: | 280.24 | Num_heavy_atoms: | 21 |
| TPSA: | 80.65 | NumAromaticRings: | 4 |
