Glycoside
GD122057
Name:
6,9-dihydroxy-9-methyl-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-5,7,8,9,10,12-hexahydrotetracene-5,12-dioneFormula:
C25H26O9Smiles:
CC1OC(OC2CC(C)(O)Cc3cc4c(c(O)c32)C(=O)c2ccccc2C4=O)C(O)C(O)C1OAglycone:
CC1(O)Cc2cc3c(c(O)c2C(O)C1)C(=O)c1ccccc1C3=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | 0.75 | Num_rotatable_bonds: | 2 |
| MolWt: | 470.47 | Num_heavy_atoms: | 34 |
| TPSA: | 153.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD49164
Formula: C19H16O5
Smiles:
CC1(O)Cc2cc3c(c(O)c2C(O)C1)C(=O)c1ccccc1C3=O| HBA: | 5 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.26 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 0 |
| MolWt: | 324.33 | Num_heavy_atoms: | 24 |
| TPSA: | 94.83 | NumAromaticRings: | 2 |
