Glycoside
...
GD004792

Name:
WOORENOSIDE V

Formula:
C31H38O13

Smiles:
C=C(CCO)C(=O)OC[C@@H]1O[C@H](OCC=Cc2cc(OC)c3c(c2)[C@H](CO)[C@H](c2ccc(O)c(OC)c2)O3)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
C=C(CCO)C(=O)OC.COc1cc(C2Oc3c(OC)cc(C=CCO)cc3C2CO)ccc1O

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 6 FractionCSP3: 0.45
AlogP: 0.94 Num_rotatable_bonds: 13
MolWt: 618.63 Num_heavy_atoms: 44
TPSA: 193.83 NumAromaticRings: 2

Unique Aglycone
AD02615
Formula: C6H10O3

Smiles:
C=C(CCO)C(=O)OC
HBA: 3 RingCount: 0
HBD: 1 FractionCSP3: 0.5
AlogP: 0.1 Num_rotatable_bonds: 3
MolWt: 130.14 Num_heavy_atoms: 9
TPSA: 46.53 NumAromaticRings: 0
AD04143
Formula: C20H22O6

Smiles:
COc1cc(C2Oc3c(OC)cc(C=CCO)cc3C2CO)ccc1O
HBA: 6 RingCount: 3
HBD: 3 FractionCSP3: 0.3
AlogP: 2.62 Num_rotatable_bonds: 6
MolWt: 358.39 Num_heavy_atoms: 26
TPSA: 88.38 NumAromaticRings: 2

Sugarmoiety
SD00017

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