Glycoside
...
GD012690

Name:
None

Formula:
C45H74O16

Smiles:
CCOCOC[C@@H]1O[C@H](O[C@@H]2CC[C@]3(C)C4C(=O)C[C@]5(C)C(CC6O[C@]7(CC[C@H](C)CO7)[C@H](C)C65)C4CC[C@H]3C2)[C@H](O)[C@@H](O)[C@@H]1O[C@H]1O[C@@H](COCOCC)[C@H](O)[C@@H](O)[C@H]1O

Aglycone:
CC1CCC2(OC1)OC1CC3C4CCC5CC(O)CCC5(C)C4C(=O)CC3(C)C1C2C.CCOCOC.CCOCOC

Sugarmoiety:
OC1OC(OC2C(O)OC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 8
HBD: 5 FractionCSP3: 0.98
AlogP: 2.66 Num_rotatable_bonds: 14
MolWt: 871.07 Num_heavy_atoms: 61
TPSA: 210.52 NumAromaticRings: 0

Unique Aglycone
AD01997
Formula: C27H42O4

Smiles:
CC1CCC2(OC1)OC1CC3C4CCC5CC(O)CCC5(C)C4C(=O)CC3(C)C1C2C
HBA: 4 RingCount: 6
HBD: 1 FractionCSP3: 0.96
AlogP: 4.97 Num_rotatable_bonds: 0
MolWt: 430.63 Num_heavy_atoms: 31
TPSA: 55.76 NumAromaticRings: 0
AD09544
Formula: C4H10O2

Smiles:
CCOCOC
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 1.0
AlogP: 0.63 Num_rotatable_bonds: 3
MolWt: 90.12 Num_heavy_atoms: 6
TPSA: 18.46 NumAromaticRings: 0

Sugarmoiety
SD00502

OC1OC(OC2C(O)OC(O)C(O)C2O)C(O)C(O)C1O