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-triol

Formula:
C51H86O42

Smiles:
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

Aglycone:
[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)C1O

Other 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