Glycoside
...
GD154019

Name:
methyl 6-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}-7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-4-carboxylate

Formula:
C27H34O13

Smiles:
COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC(OC(=O)C=Cc1ccc(O)c(OC)c1)C2C

Aglycone:
COC(=O)C1=COC(O)C2C1CC(OC(=O)C=Cc1ccc(O)c(OC)c1)C2C

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 5 FractionCSP3: 0.56
AlogP: -0.17 Num_rotatable_bonds: 8
MolWt: 566.56 Num_heavy_atoms: 40
TPSA: 190.67 NumAromaticRings: 1

Unique Aglycone
AD59598
Formula: C21H24O8

Smiles:
COC(=O)C1=COC(O)C2C1CC(OC(=O)C=Cc1ccc(O)c(OC)c1)C2C
HBA: 8 RingCount: 3
HBD: 2 FractionCSP3: 0.43
AlogP: 2.0 Num_rotatable_bonds: 5
MolWt: 404.42 Num_heavy_atoms: 29
TPSA: 111.52 NumAromaticRings: 1

Sugarmoiety
SD00003

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