Glycoside
...
GD132274

Name:
2,16,17-trihydroxy-7,11-dimethyl-6-{1-[5-methyl-6-oxo-4-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-3,6-dihydro-2H-pyran-2-yl]ethyl}-12-oxo-5-oxapentacyclo[8.8.0.0²,⁷.0⁴,⁶.0¹¹,¹⁶]octadec-13-en-3-yl acetate

Formula:
C36H50O15

Smiles:
CC(=O)OC1C2OC2(C(C)C2CC(COC3OC(CO)C(O)C(O)C3O)=C(C)C(=O)O2)C2(C)CCC3C(CC(O)C4(O)CC=CC(=O)C34C)C12O

Aglycone:
CC(=O)OC1C2OC2(C(C)C2CC(CO)=C(C)C(=O)O2)C2(C)CCC3C(CC(O)C4(O)CC=CC(=O)C34C)C12O

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

Other Identifiers

Properties
HBA: 15 RingCount: 7
HBD: 7 FractionCSP3: 0.81
AlogP: -1.05 Num_rotatable_bonds: 7
MolWt: 722.78 Num_heavy_atoms: 51
TPSA: 242.27 NumAromaticRings: 0

Unique Aglycone
AD53546
Formula: C30H40O10

Smiles:
CC(=O)OC1C2OC2(C(C)C2CC(CO)=C(C)C(=O)O2)C2(C)CCC3C(CC(O)C4(O)CC=CC(=O)C34C)C12O
HBA: 10 RingCount: 6
HBD: 4 FractionCSP3: 0.77
AlogP: 1.12 Num_rotatable_bonds: 4
MolWt: 560.64 Num_heavy_atoms: 40
TPSA: 163.12 NumAromaticRings: 0

Sugarmoiety
SD00003

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