Glycoside
...
GD125128

Name:
Dactylorhin B

Formula:
C40H56O23

Smiles:
CCC(C)C(OC1OC(CO)C(O)C(O)C1O)(C(=O)OCc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1)C(O)C(=O)OCc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1

Aglycone:
Cc1ccc(O)cc1.Cc1ccc(O)cc1

Sugarmoiety:
CCC(C)C(OC1OC(CO)C(O)C(O)C1O)(C(=O)OO)C(O)C(=O)OO.OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 23 RingCount: 5
HBD: 13 FractionCSP3: 0.65
AlogP: -5.21 Num_rotatable_bonds: 18
MolWt: 904.87 Num_heavy_atoms: 63
TPSA: 370.97 NumAromaticRings: 2

Unique Aglycone
AD00732
Formula: C7H8O

Smiles:
Cc1ccc(O)cc1
HBA: 1 RingCount: 1
HBD: 1 FractionCSP3: 0.14
AlogP: 1.7 Num_rotatable_bonds: 0
MolWt: 108.14 Num_heavy_atoms: 8
TPSA: 20.23 NumAromaticRings: 1

Sugarmoiety
SD06421

CCC(C)C(OC1OC(CO)C(O)C(O)C1O)(C(=O)OO)C(O)C(=O)OO.OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O