Glycoside
...
GD029522

Name:
None

Formula:
C34H48O11

Smiles:
CC(=O)OC[C@@H]1O[C@H](OC2CC[C@]3(C)C(CC[C@@H]4[C@H]3CC[C@]3(C)[C@H](C5=CC(=O)OC5)CC[C@]43O)C2)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
CC12CCC(O)CC1CCC1C2CCC2(C)C(C3=CC(=O)OC3)CCC12O.COC(C)=O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C1OC(C)=O

Other Identifiers

Properties
HBA: 11 RingCount: 6
HBD: 1 FractionCSP3: 0.82
AlogP: 3.78 Num_rotatable_bonds: 7
MolWt: 632.75 Num_heavy_atoms: 45
TPSA: 143.89 NumAromaticRings: 0

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD01378
Formula: C23H34O4

Smiles:
CC12CCC(O)CC1CCC1C2CCC2(C)C(C3=CC(=O)OC3)CCC12O
HBA: 4 RingCount: 5
HBD: 2 FractionCSP3: 0.87
AlogP: 3.6 Num_rotatable_bonds: 1
MolWt: 374.52 Num_heavy_atoms: 27
TPSA: 66.76 NumAromaticRings: 0

Sugarmoiety
SD00105

CC(=O)OC1C(O)OC(O)C1OC(C)=O