Glycoside
...
GD130720

Name:
Youngiaside B

Formula:
C29H34O11

Smiles:
C=C1C(=O)OC2C1CC(O)C(C)=C1CC=C(COC3OC(CO)C(O)C(OC(=O)Cc4ccc(O)cc4)C3O)C12

Aglycone:
C=C1C(=O)OC2C1CC(O)C(C)=C1CC=C(CO)C12.O=C(O)Cc1ccc(O)cc1

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

Other Identifiers

Properties
HBA: 11 RingCount: 5
HBD: 5 FractionCSP3: 0.52
AlogP: 0.43 Num_rotatable_bonds: 7
MolWt: 558.58 Num_heavy_atoms: 40
TPSA: 172.21 NumAromaticRings: 1

Unique Aglycone
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
AD45457
Formula: C15H18O4

Smiles:
C=C1C(=O)OC2C1CC(O)C(C)=C1CC=C(CO)C12
HBA: 4 RingCount: 3
HBD: 2 FractionCSP3: 0.53
AlogP: 1.1 Num_rotatable_bonds: 1
MolWt: 262.3 Num_heavy_atoms: 19
TPSA: 66.76 NumAromaticRings: 0

Sugarmoiety
SD00003

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