Glycoside
...
GD121697

Name:
7-(furan-3-yl)-1,8,12,16,16-pentamethyl-5-oxo-15-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,6-dioxapentacyclo[9.8.0.0²,⁴.0²,⁸.0¹²,¹⁷]nonadec-13-en-19-yl acetate

Formula:
C34H46O12

Smiles:
CC(=O)OC1CC2C(C)(C)C(OC3OC(CO)C(O)C(O)C3O)C=CC2(C)C2CCC3(C)C(c4ccoc4)OC(=O)C4OC43C12C

Aglycone:
CC(=O)OC1CC2C(C)(C)C(O)C=CC2(C)C2CCC3(C)C(c4ccoc4)OC(=O)C4OC43C12C

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 7
HBD: 4 FractionCSP3: 0.76
AlogP: 2.18 Num_rotatable_bonds: 5
MolWt: 646.73 Num_heavy_atoms: 46
TPSA: 177.65 NumAromaticRings: 1

Unique Aglycone
AD49000
Formula: C28H36O7

Smiles:
CC(=O)OC1CC2C(C)(C)C(O)C=CC2(C)C2CCC3(C)C(c4ccoc4)OC(=O)C4OC43C12C
HBA: 7 RingCount: 6
HBD: 1 FractionCSP3: 0.71
AlogP: 4.35 Num_rotatable_bonds: 2
MolWt: 484.59 Num_heavy_atoms: 35
TPSA: 98.5 NumAromaticRings: 1

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O