Glycoside
...
GD155499

Name:
None

Formula:
C67H106O32

Smiles:
C=C(C)CCCC1(C)OC(=O)C23CC=C4C(CCC5C4(C)CCC(OC4OCC(OC6OC(CO)C(OC7OC(CO)C(O)C(OC)C7O)C(O)C6O)C(O)C4OC4OC(C)C(OC6OC(CO)C(O)C(OC7OC(CO)C(O)C(OC)C7O)C6O)C(O)C4O)C5(C)C)C2(C)CC(=O)C13

Aglycone:
C=C(C)CCCC1(C)OC(=O)C23CC=C4C(CCC5C4(C)CCC(O)C5(C)C)C2(C)CC(=O)C13

Sugarmoiety:
COC1C(O)C(CO)OC(OC2C(CO)OC(OC3COC(O)C(OC4OC(C)C(OC5OC(CO)C(O)C(OC6OC(CO)C(O)C(OC)C6O)C5O)C(O)C4O)C3O)C(O)C2O)C1O

Other Identifiers

Properties
HBA: 32 RingCount: 11
HBD: 15 FractionCSP3: 0.91
AlogP: -3.91 Num_rotatable_bonds: 22
MolWt: 1423.55 Num_heavy_atoms: 99
TPSA: 476.04 NumAromaticRings: 0

Unique Aglycone
AD00886
Formula: C30H44O4

Smiles:
C=C(C)CCCC1(C)OC(=O)C23CC=C4C(CCC5C4(C)CCC(O)C5(C)C)C2(C)CC(=O)C13
HBA: 4 RingCount: 5
HBD: 1 FractionCSP3: 0.8
AlogP: 6.17 Num_rotatable_bonds: 4
MolWt: 468.68 Num_heavy_atoms: 34
TPSA: 63.6 NumAromaticRings: 0

Sugarmoiety
SD05820

COC1C(O)C(CO)OC(OC2C(CO)OC(OC3COC(O)C(OC4OC(C)C(OC5OC(CO)C(O)C(OC6OC(CO)C(O)C(OC)C6O)C5O)C(O)C4O)C3O)C(O)C2O)C1O