Glycoside
...
GD130490

Name:
(6-{[1,7-bis(3,4-dihydroxyphenyl)heptan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl)methyl 3-(3,4-dimethoxyphenyl)prop-2-enoate

Formula:
C36H44O13

Smiles:
COc1ccc(C=CC(=O)OCC2OC(OC(CCCCc3ccc(O)c(O)c3)CCc3ccc(O)c(O)c3)C(O)C(O)C2O)cc1OC

Aglycone:
COC(=O)C=Cc1ccc(OC)c(OC)c1.Oc1ccc(CCCCC(O)CCc2ccc(O)c(O)c2)cc1O

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 7 FractionCSP3: 0.42
AlogP: 3.32 Num_rotatable_bonds: 16
MolWt: 684.74 Num_heavy_atoms: 49
TPSA: 204.83 NumAromaticRings: 3

Unique Aglycone
AD01667
Formula: C19H24O5

Smiles:
Oc1ccc(CCCCC(O)CCc2ccc(O)c(O)c2)cc1O
HBA: 5 RingCount: 2
HBD: 5 FractionCSP3: 0.37
AlogP: 3.22 Num_rotatable_bonds: 8
MolWt: 332.4 Num_heavy_atoms: 24
TPSA: 101.15 NumAromaticRings: 2
AD07423
Formula: C12H14O4

Smiles:
COC(=O)C=Cc1ccc(OC)c(OC)c1
HBA: 4 RingCount: 1
HBD: 0 FractionCSP3: 0.25
AlogP: 1.89 Num_rotatable_bonds: 4
MolWt: 222.24 Num_heavy_atoms: 16
TPSA: 44.76 NumAromaticRings: 1

Sugarmoiety
SD00017

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