Glycoside
...
GD139333

Name:
3-[(3-{[3-({3-[(3-{[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]-6-(hydroxymethyl)oxane-2,4,5-triol

Formula:
C42H72O36

Smiles:
OCC1OC(OC2C(OC3C(OC4C(OC5C(OC6C(OC7C(O)OC(CO)C(O)C7O)OC(CO)C(O)C6O)OC(CO)C(O)C5O)OC(CO)C(O)C4O)OC(CO)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O

Aglycone:
[empty]

Sugarmoiety:
OCC1OC(OC2C(OC3C(OC4C(OC5C(OC6C(OC7C(O)OC(CO)C(O)C7O)OC(CO)C(O)C6O)OC(CO)C(O)C5O)OC(CO)C(O)C4O)OC(CO)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 36 RingCount: 7
HBD: 23 FractionCSP3: 1.0
AlogP: -16.28 Num_rotatable_bonds: 19
MolWt: 1153.0 Num_heavy_atoms: 78
TPSA: 585.28 NumAromaticRings: 0

Unique Aglycone

Sugarmoiety
SD08430

OCC1OC(OC2C(OC3C(OC4C(OC5C(OC6C(OC7C(O)OC(CO)C(O)C7O)OC(CO)C(O)C6O)OC(CO)C(O)C5O)OC(CO)C(O)C4O)OC(CO)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O