Glycoside
GD014903
Name:
3-(3,4-dihydroxy-1-methoxy-2-oxopentyl)-2,6,8,9-tetrahydroxy-1,2,3,4-tetrahydroanthracen-1-oneFormula:
C20H22O9Smiles:
COC(C(=O)[C@H](O)[C@H](C)O)C1Cc2cc3cc(O)cc(O)c3c(O)c2C(=O)C1OAglycone:
O=C1c2c(cc3cc(O)cc(O)c3c2O)CCC1OSugarmoiety:
COC(O)C(=O)C(O)C(C)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | 0.0 | Num_rotatable_bonds: | 5 |
| MolWt: | 406.39 | Num_heavy_atoms: | 29 |
| TPSA: | 164.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD00371
Formula: C14H12O5
Smiles:
O=C1c2c(cc3cc(O)cc(O)c3c2O)CCC1O| HBA: | 5 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.21 |
| AlogP: | 1.45 | Num_rotatable_bonds: | 0 |
| MolWt: | 260.24 | Num_heavy_atoms: | 19 |
| TPSA: | 97.99 | NumAromaticRings: | 2 |
