Glycoside
...
GD027960

Name:
Tetracentronside B

Formula:
C26H32O11

Smiles:
OC[C@@H]1O[C@H](OC[C@H](Cc2ccc3c(c2)OCO3)[C@H](CO)Cc2ccc3c(c2)OCO3)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
OCC(Cc1ccc2c(c1)OCO2)C(CO)Cc1ccc2c(c1)OCO2

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

Other Identifiers

Properties
HBA: 11 RingCount: 5
HBD: 5 FractionCSP3: 0.54
AlogP: -0.03 Num_rotatable_bonds: 10
MolWt: 520.53 Num_heavy_atoms: 37
TPSA: 156.53 NumAromaticRings: 2

Unique Aglycone
AD07676
Formula: C20H22O6

Smiles:
OCC(Cc1ccc2c(c1)OCO2)C(CO)Cc1ccc2c(c1)OCO2
HBA: 6 RingCount: 4
HBD: 2 FractionCSP3: 0.4
AlogP: 2.15 Num_rotatable_bonds: 7
MolWt: 358.39 Num_heavy_atoms: 26
TPSA: 77.38 NumAromaticRings: 2

Sugarmoiety
SD00003

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