Glycoside
...
GD157277

Name:
Hymenoside E

Formula:
C27H32O13

Smiles:
CC(=CCO)COC1OC(COC(=O)Cc2ccc(O)c(O)c2)C(O)C(O)C1OC(=O)Cc1ccc(O)c(O)c1

Aglycone:
CC(=CCO)CO.COC(=O)Cc1ccc(O)c(O)c1.O=C(O)Cc1ccc(O)c(O)c1

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

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 7 FractionCSP3: 0.41
AlogP: 0.15 Num_rotatable_bonds: 11
MolWt: 564.54 Num_heavy_atoms: 40
TPSA: 212.67 NumAromaticRings: 2

Unique Aglycone
AD00758
Formula: C8H8O4

Smiles:
O=C(O)Cc1ccc(O)c(O)c1
HBA: 4 RingCount: 1
HBD: 3 FractionCSP3: 0.12
AlogP: 0.72 Num_rotatable_bonds: 2
MolWt: 168.15 Num_heavy_atoms: 12
TPSA: 77.76 NumAromaticRings: 1
AD15409
Formula: C5H10O2

Smiles:
CC(=CCO)CO
HBA: 2 RingCount: 0
HBD: 2 FractionCSP3: 0.6
AlogP: -0.08 Num_rotatable_bonds: 2
MolWt: 102.13 Num_heavy_atoms: 7
TPSA: 40.46 NumAromaticRings: 0
AD21642
Formula: C9H10O4

Smiles:
COC(=O)Cc1ccc(O)c(O)c1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.22
AlogP: 0.81 Num_rotatable_bonds: 2
MolWt: 182.18 Num_heavy_atoms: 13
TPSA: 66.76 NumAromaticRings: 1

Sugarmoiety
SD00017

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