Glycoside
...
GD140412

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

Formula:
C40H68O33

Smiles:
CC1OC(O)C(O)C(O)C1OC1OCC(OC2OCC(OC3OC(CO)C(OC4OC(CO)C(OC5OC(CO)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O

Aglycone:
[empty]

Sugarmoiety:
CC1OC(O)C(O)C(O)C1OC1OCC(OC2OCC(OC3OC(CO)C(OC4OC(CO)C(OC5OC(CO)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 33 RingCount: 7
HBD: 20 FractionCSP3: 1.0
AlogP: -13.97 Num_rotatable_bonds: 16
MolWt: 1076.95 Num_heavy_atoms: 73
TPSA: 524.59 NumAromaticRings: 0

Unique Aglycone

Sugarmoiety
SD08580

CC1OC(O)C(O)C(O)C1OC1OCC(OC2OCC(OC3OC(CO)C(OC4OC(CO)C(OC5OC(CO)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O