Glycoside
...
GD126766

Name:
7-{[(5-phenylpenta-2,4-dienoyl)oxy]methyl}-1-{[3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}-1H,4aH,5H,7aH-cyclopenta[c]pyran-4-carboxylic acid

Formula:
C35H38O15

Smiles:
CC(=O)OCC1OC(OC2OC=C(C(=O)O)C3CC=C(COC(=O)C=CC=Cc4ccccc4)C23)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Aglycone:
COC(C)=O.O=C(C=CC=Cc1ccccc1)OCC1=CCC2C(C(=O)O)=COC(O)C12

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 15 RingCount: 4
HBD: 1 FractionCSP3: 0.43
AlogP: 2.79 Num_rotatable_bonds: 13
MolWt: 698.67 Num_heavy_atoms: 50
TPSA: 196.49 NumAromaticRings: 1

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD51306
Formula: C21H20O6

Smiles:
O=C(C=CC=Cc1ccccc1)OCC1=CCC2C(C(=O)O)=COC(O)C12
HBA: 6 RingCount: 3
HBD: 2 FractionCSP3: 0.24
AlogP: 2.68 Num_rotatable_bonds: 6
MolWt: 368.39 Num_heavy_atoms: 27
TPSA: 93.06 NumAromaticRings: 1

Sugarmoiety
SD00012

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O