Glycoside
GD133714
Name:
3'-(3,7-dimethyl-2,6-octadienyl)-8-glucosyl-3,4',5,7-tetrahydroxyflavone; (e)-form, 3-o-β-d-glucopyranosideFormula:
C37H46O16Smiles:
CC(C)=CCCC(C)=CCc1cc(-c2oc3c(C4OC(CO)C(O)C(O)C4O)c(O)cc(O)c3c(=O)c2OC2OC(CO)C(O)C(O)C2O)ccc1OAglycone:
CC(C)=CCCC(C)=CCc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 11 | FractionCSP3: | 0.49 |
| AlogP: | 0.51 | Num_rotatable_bonds: | 11 |
| MolWt: | 746.76 | Num_heavy_atoms: | 53 |
| TPSA: | 280.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD49439
Formula: C25H26O6
Smiles:
CC(C)=CCCC(C)=CCc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.24 |
| AlogP: | 5.52 | Num_rotatable_bonds: | 6 |
| MolWt: | 422.48 | Num_heavy_atoms: | 31 |
| TPSA: | 111.13 | NumAromaticRings: | 3 |
