Glycoside
...
GD120226

Name:
3-oxo-3-{[3,4,6-trihydroxy-5-({17-[(4-hydroxyphenyl)methyl]-5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-2(10),3,8,13,15,17-hexaen-15-yl}peroxy)oxan-2-yl]methoxy}propanoic acid

Formula:
C32H30O15

Smiles:
O=C(O)CC(=O)OCC1OC(O)C(OOc2cc(Cc3ccc(O)cc3)c3c(c2)C2Oc4cc5c(cc4C2CO3)OCO5)C(O)C1O

Aglycone:
COC(=O)CC(=O)O.OOc1cc(Cc2ccc(O)cc2)c2c(c1)C1Oc3cc4c(cc3C1CO2)OCO4

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 7
HBD: 5 FractionCSP3: 0.38
AlogP: 1.46 Num_rotatable_bonds: 9
MolWt: 654.58 Num_heavy_atoms: 47
TPSA: 209.13 NumAromaticRings: 3

Unique Aglycone
AD04733
Formula: C4H6O4

Smiles:
COC(=O)CC(=O)O
HBA: 4 RingCount: 0
HBD: 1 FractionCSP3: 0.5
AlogP: -0.37 Num_rotatable_bonds: 2
MolWt: 118.09 Num_heavy_atoms: 8
TPSA: 63.6 NumAromaticRings: 0
AD48268
Formula: C23H18O7

Smiles:
OOc1cc(Cc2ccc(O)cc2)c2c(c1)C1Oc3cc4c(cc3C1CO2)OCO4
HBA: 7 RingCount: 6
HBD: 2 FractionCSP3: 0.22
AlogP: 4.17 Num_rotatable_bonds: 3
MolWt: 406.39 Num_heavy_atoms: 30
TPSA: 86.61 NumAromaticRings: 3

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O