Glycoside
GD127519
Name:
5-{[5-({3,4-dihydroxy-5-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl}oxy)-6-{[(3-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-4,5-dihydroxyoxan-2-yl)oxy]methyl}-3,4-dihydroxyoxan-2-yl]oxy}-6-(hydroxymethyl)oxane-2,3,4-triolFormula:
C51H86O42Smiles:
CC1OC(OC2C(OC3C(OCC4OC(OC5C(CO)OC(O)C(O)C5O)C(O)C(O)C4OC4OC(COC5OCC(O)C(O)C5O)C(OC5OC(COC6OCC(O)C(O)C6O)C(O)C(O)C5O)C(O)C4O)OCC(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1OAglycone:
[empty]Sugarmoiety:
CC1OC(OC2C(OC3C(OCC4OC(OC5C(CO)OC(O)C(O)C5O)C(O)C(O)C4OC4OC(COC5OCC(O)C(O)C5O)C(OC5OC(COC6OCC(O)C(O)C6O)C(O)C(O)C5O)C(O)C4O)OCC(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 42 | RingCount: | 9 |
| HBD: | 25 | FractionCSP3: | 1.0 |
| AlogP: | -17.68 | Num_rotatable_bonds: | 21 |
| MolWt: | 1371.21 | Num_heavy_atoms: | 93 |
| TPSA: | 662.66 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD06787
CC1OC(OC2C(OC3C(OCC4OC(OC5C(CO)OC(O)C(O)C5O)C(O)C(O)C4OC4OC(COC5OCC(O)C(O)C5O)C(OC5OC(COC6OCC(O)C(O)C6O)C(O)C(O)C5O)C(O)C4O)OCC(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O