Glycoside
...
GD015227

Name:
None

Formula:
C42H62O10

Smiles:
CC(C)[C@H](C)[C@]1(C)CC[C@]2(C)[C@@H]3CC[C@H]4[C@]5(COC[C@]4(C)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@@H](Oc4ccccc4)C5)C3=CC[C@@]2(C)[C@H]1C(=O)O

Aglycone:
CC(C)C(C)C1(C)CCC2(C)C3CCC4C5(COCC4(C)C(O)C(Oc4ccccc4)C5)C3=CCC2(C)C1C(=O)O

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

Other Identifiers

Properties
HBA: 10 RingCount: 7
HBD: 5 FractionCSP3: 0.79
AlogP: 5.21 Num_rotatable_bonds: 8
MolWt: 726.95 Num_heavy_atoms: 52
TPSA: 155.14 NumAromaticRings: 1

Unique Aglycone
AD11085
Formula: C36H52O5

Smiles:
CC(C)C(C)C1(C)CCC2(C)C3CCC4C5(COCC4(C)C(O)C(Oc4ccccc4)C5)C3=CCC2(C)C1C(=O)O
HBA: 5 RingCount: 6
HBD: 2 FractionCSP3: 0.75
AlogP: 7.38 Num_rotatable_bonds: 5
MolWt: 564.81 Num_heavy_atoms: 41
TPSA: 75.99 NumAromaticRings: 1

Sugarmoiety
SD00003

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