Glycoside
GD152440
Name:
2,8-dihydroxy-1-methoxy-6-methyl-10-(3,4,5,6-tetrahydroxyoxan-2-yl)-9,10-dihydroanthracen-9-oneFormula:
C21H22O9Smiles:
COc1c(O)ccc2c1C(=O)c1c(O)cc(C)cc1C2C1OC(O)C(O)C(O)C1OAglycone:
COc1c(O)ccc2c1C(=O)c1c(O)cc(C)cc1C2Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.38 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 2 |
| MolWt: | 418.4 | Num_heavy_atoms: | 30 |
| TPSA: | 156.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD58148
Formula: C16H14O4
Smiles:
COc1c(O)ccc2c1C(=O)c1c(O)cc(C)cc1C2| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.19 |
| AlogP: | 2.55 | Num_rotatable_bonds: | 1 |
| MolWt: | 270.28 | Num_heavy_atoms: | 20 |
| TPSA: | 66.76 | NumAromaticRings: | 2 |
