Glycoside
GD118981
Name:
Asperxanthone; 10-O-De-Me, 10-O-[β-D-Glucopyranosyl-(1->6)-β-D-Glucopyranoside]Formula:
C27H32O15Smiles:
COc1cc(OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)c2c(c1)cc(O)c1c(=O)cc(C)oc12Aglycone:
COc1cc(O)c2c(c1)cc(O)c1c(=O)cc(C)oc12Sugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.52 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 7 |
| MolWt: | 596.54 | Num_heavy_atoms: | 42 |
| TPSA: | 238.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD47615
Formula: C15H12O5
Smiles:
COc1cc(O)c2c(c1)cc(O)c1c(=O)cc(C)oc12| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 2.67 | Num_rotatable_bonds: | 1 |
| MolWt: | 272.26 | Num_heavy_atoms: | 20 |
| TPSA: | 79.9 | NumAromaticRings: | 3 |
