Glycoside
...
GD152405

Name:
5-[2-(3,4-dihydroxyphenyl)ethoxy]-6-hydroxy-2-(hydroxymethyl)-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

Formula:
C30H38O15

Smiles:
COc1cc(C=CC(=O)OC2C(CO)OC(O)C(OCCc3ccc(O)c(O)c3)C2OC2OC(C)C(O)C(O)C2O)ccc1O

Aglycone:
COc1cc(C=CC(=O)O)ccc1O.OCCc1ccc(O)c(O)c1

Sugarmoiety:
CC1OC(OC2C(O)C(O)OC(CO)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 4
HBD: 8 FractionCSP3: 0.5
AlogP: -0.71 Num_rotatable_bonds: 11
MolWt: 638.62 Num_heavy_atoms: 45
TPSA: 234.29 NumAromaticRings: 2

Unique Aglycone
AD00128
Formula: C8H10O3

Smiles:
OCCc1ccc(O)c(O)c1
HBA: 3 RingCount: 1
HBD: 3 FractionCSP3: 0.25
AlogP: 0.63 Num_rotatable_bonds: 2
MolWt: 154.16 Num_heavy_atoms: 11
TPSA: 60.69 NumAromaticRings: 1
AD00175
Formula: C10H10O4

Smiles:
COc1cc(C=CC(=O)O)ccc1O
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.1
AlogP: 1.5 Num_rotatable_bonds: 3
MolWt: 194.19 Num_heavy_atoms: 14
TPSA: 66.76 NumAromaticRings: 1

Sugarmoiety
SD00323

CC1OC(OC2C(O)C(O)OC(CO)C2O)C(O)C(O)C1O