Glycoside
...
GD145563

Name:
Ixerin P

Formula:
C34H42O13

Smiles:
C=C1CC(OC(=O)C(O)C(C)C)C2C(=C)C(=O)OC2C2C(=C)C(OC3OC(COC(=O)Cc4ccc(O)cc4)C(O)C(O)C3O)CC12

Aglycone:
C=C1CC(OC(=O)C(O)C(C)C)C2C(=C)C(=O)OC2C2C(=C)C(O)CC12.COC(=O)Cc1ccc(O)cc1

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

Other Identifiers

Properties
HBA: 13 RingCount: 5
HBD: 5 FractionCSP3: 0.56
AlogP: 0.85 Num_rotatable_bonds: 9
MolWt: 658.7 Num_heavy_atoms: 47
TPSA: 198.51 NumAromaticRings: 1

Unique Aglycone
AD02427
Formula: C9H10O3

Smiles:
COC(=O)Cc1ccc(O)cc1
HBA: 3 RingCount: 1
HBD: 1 FractionCSP3: 0.22
AlogP: 1.11 Num_rotatable_bonds: 2
MolWt: 166.18 Num_heavy_atoms: 12
TPSA: 46.53 NumAromaticRings: 1
AD07772
Formula: C20H26O6

Smiles:
C=C1CC(OC(=O)C(O)C(C)C)C2C(=C)C(=O)OC2C2C(=C)C(O)CC12
HBA: 6 RingCount: 3
HBD: 2 FractionCSP3: 0.6
AlogP: 1.53 Num_rotatable_bonds: 3
MolWt: 362.42 Num_heavy_atoms: 26
TPSA: 93.06 NumAromaticRings: 0

Sugarmoiety
SD00017

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