Glycoside
...
GD149766

Name:
Hymenoside C

Formula:
C27H32O12

Smiles:
CC(=CCO)COC1OC(CO)C(O)C(OC(=O)Cc2ccc(O)cc2)C1OC(=O)Cc1ccc(O)c(O)c1

Aglycone:
CC(=CCO)CO.O=C(O)Cc1ccc(O)c(O)c1.O=C(O)Cc1ccc(O)cc1

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

Other Identifiers

Properties
HBA: 12 RingCount: 3
HBD: 6 FractionCSP3: 0.41
AlogP: 0.45 Num_rotatable_bonds: 11
MolWt: 548.54 Num_heavy_atoms: 39
TPSA: 192.44 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
AD05358
Formula: C8H8O3

Smiles:
O=C(O)Cc1ccc(O)cc1
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.12
AlogP: 1.02 Num_rotatable_bonds: 2
MolWt: 152.15 Num_heavy_atoms: 11
TPSA: 57.53 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

Sugarmoiety
SD00003

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