Glycoside
...
GD157814

Name:
methyl 15,16-dihydroxy-9,13-dimethyl-4,10-dioxo-3-phenoxy-11-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,18-dioxapentacyclo[12.5.0.0¹,⁶.0²,¹⁷.0⁸,¹³]nonadec-11-ene-17-carboxylate

Formula:
C33H40O15

Smiles:
COC(=O)C12OCC34C(CC5C(C)C(=O)C(OC6OC(CO)C(O)C(O)C6O)=CC5(C)C3C(O)C1O)OC(=O)C(Oc1ccccc1)C24

Aglycone:
COC(=O)C12OCC34C(CC5C(C)C(=O)C(O)=CC5(C)C3C(O)C1O)OC(=O)C(Oc1ccccc1)C24

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

Other Identifiers

Properties
HBA: 15 RingCount: 7
HBD: 6 FractionCSP3: 0.67
AlogP: -1.8 Num_rotatable_bonds: 6
MolWt: 676.67 Num_heavy_atoms: 48
TPSA: 227.97 NumAromaticRings: 1

Unique Aglycone
AD62354
Formula: C27H30O10

Smiles:
COC(=O)C12OCC34C(CC5C(C)C(=O)C(O)=CC5(C)C3C(O)C1O)OC(=O)C(Oc1ccccc1)C24
HBA: 10 RingCount: 6
HBD: 3 FractionCSP3: 0.59
AlogP: 0.94 Num_rotatable_bonds: 3
MolWt: 514.53 Num_heavy_atoms: 37
TPSA: 148.82 NumAromaticRings: 1

Sugarmoiety
SD00003

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