Glycoside
GD116996
Name:
4-({6-[({3-[(4-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl)oxy]-4,5-dihydroxyoxan-2-yl}oxy)methyl]-5-[(3,4-dihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-3,4-dihydroxyoxan-2-yl}oxy)hexane-1,2,3,5,6-pentolFormula:
C44H76O37Smiles:
OCC(O)C(O)C(OC1OC(COC2OCC(O)C(O)C2OC2OC(CO)C(OC3OC(CO)C(O)C3O)C2O)C(OC2OC(COC3OCC(O)C(O)C3O)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C1O)C(O)COAglycone:
[empty]Sugarmoiety:
OCC(O)C(O)C(OC1OC(COC2OCC(O)C(O)C2OC2OC(CO)C(OC3OC(CO)C(O)C3O)C2O)C(OC2OC(COC3OCC(O)C(O)C3O)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C1O)C(O)COOther Identifiers
Properties
| HBA: | 37 | RingCount: | 7 |
| HBD: | 23 | FractionCSP3: | 1.0 |
| AlogP: | -16.26 | Num_rotatable_bonds: | 24 |
| MolWt: | 1197.06 | Num_heavy_atoms: | 81 |
| TPSA: | 594.51 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD04966
OCC(O)C(O)C(OC1OC(COC2OCC(O)C(O)C2OC2OC(CO)C(OC3OC(CO)C(O)C3O)C2O)C(OC2OC(COC3OCC(O)C(O)C3O)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C1O)C(O)CO