Glycoside
GD118628
Name:
AmorphinFormula:
C34H40O16Smiles:
C=C(COC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)C1Cc2c(ccc3c2OC2COc4cc(OC)c(OC)cc4C2C3=O)O1Aglycone:
C=C(CO)C1Cc2c(ccc3c2OC2COc4cc(OC)c(OC)cc4C2C3=O)O1Sugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 7 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -1.04 | Num_rotatable_bonds: | 9 |
| MolWt: | 704.68 | Num_heavy_atoms: | 50 |
| TPSA: | 221.52 | NumAromaticRings: | 2 |
Unique Aglycone
AD44335
Formula: C23H22O7
Smiles:
C=C(CO)C1Cc2c(ccc3c2OC2COc4cc(OC)c(OC)cc4C2C3=O)O1| HBA: | 7 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.35 |
| AlogP: | 2.68 | Num_rotatable_bonds: | 4 |
| MolWt: | 410.42 | Num_heavy_atoms: | 30 |
| TPSA: | 83.45 | NumAromaticRings: | 2 |
