Glycoside
...
GD146416

Name:
6-{[17-(acetyloxy)-6-(furan-3-yl)-1,7,11,15,15-pentamethyl-18-oxo-3-oxapentacyclo[8.8.0.0²,⁴.0²,⁷.0¹¹,¹⁶]octadeca-12,16-dien-14-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

Formula:
C34H42O12

Smiles:
CC(=O)OC1=C2C(C)(C)C(OC3OC(C(=O)O)C(O)C(O)C3O)C=CC2(C)C2CCC3(C)C(c4ccoc4)CC4OC43C2(C)C1=O

Aglycone:
CC(=O)OC1=C2C(C)(C)C(O)C=CC2(C)C2CCC3(C)C(c4ccoc4)CC4OC43C2(C)C1=O

Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 7
HBD: 4 FractionCSP3: 0.68
AlogP: 2.61 Num_rotatable_bonds: 5
MolWt: 642.7 Num_heavy_atoms: 46
TPSA: 185.49 NumAromaticRings: 1

Unique Aglycone
AD58710
Formula: C28H34O6

Smiles:
CC(=O)OC1=C2C(C)(C)C(O)C=CC2(C)C2CCC3(C)C(c4ccoc4)CC4OC43C2(C)C1=O
HBA: 6 RingCount: 6
HBD: 1 FractionCSP3: 0.64
AlogP: 4.69 Num_rotatable_bonds: 2
MolWt: 466.57 Num_heavy_atoms: 34
TPSA: 89.27 NumAromaticRings: 1

Sugarmoiety
SD00030

O=C(O)C1OC(O)C(O)C(O)C1O