Glycoside
GD137602
Name:
1,8-dihydroxy-3-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}-9,10-dihydroanthracene-9,10-dioneFormula:
C21H20O9Smiles:
CC1OC(OCc2cc(O)c3c(c2)C(=O)c2cccc(O)c2C3=O)C(O)C(O)C1OAglycone:
O=C1c2cccc(O)c2C(=O)c2c(O)cc(CO)cc21Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 3 |
| MolWt: | 416.38 | Num_heavy_atoms: | 30 |
| TPSA: | 153.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD05397
Formula: C15H10O5
Smiles:
O=C1c2cccc(O)c2C(=O)c2c(O)cc(CO)cc21| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 1 |
| MolWt: | 270.24 | Num_heavy_atoms: | 20 |
| TPSA: | 94.83 | NumAromaticRings: | 2 |
