Glycoside
GD015355
Name:
6,9-Dihydroxy-2,310-Trimethoxy-6A,12A-Didehydrorotenone 9-O-GlucosideFormula:
C25H26O13Smiles:
COc1cc2c(cc1OC)-c1c(oc3cc(OC4OC(CO)C(O)C(O)C4O)c(OC)cc3c1=O)C(O)O2Aglycone:
COc1cc2c(=O)c3c(oc2cc1O)C(O)Oc1cc(OC)c(OC)cc1-3Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | 0.05 | Num_rotatable_bonds: | 6 |
| MolWt: | 534.47 | Num_heavy_atoms: | 38 |
| TPSA: | 186.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD11167
Formula: C19H16O8
Smiles:
COc1cc2c(=O)c3c(oc2cc1O)C(O)Oc1cc(OC)c(OC)cc1-3| HBA: | 8 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 2.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 372.33 | Num_heavy_atoms: | 27 |
| TPSA: | 107.59 | NumAromaticRings: | 3 |
