Glycoside

GD151438
Name:
NoneFormula:
C64H102O30Smiles:
COC1C(O)C(CO)OC(OC2C(O)C(CO)OC(OC3C(C)OC(OC4C(OC5CCC6(C)C7=CCC89C(=O)OC(C)(C(CCC(C)C)OC(C)=O)C8C(OC(C)=O)CC9(C)C7CCC6C5(C)C)OCC(OC5OC(CO)C(O)C(O)C5O)C4O)C(O)C3O)C2O)C1OAglycone:
CC(=O)OC1CC2(C)C3CCC4C(C)(CCC(O)C4(C)C)C3=CCC23C(=O)OC(C)(C(CCC(C)C)OC(C)=O)C13Sugarmoiety:
COC1C(O)C(CO)OC(OC2C(O)C(CO)OC(OC3C(C)OC(OC4C(O)OCC(OC5OC(CO)C(O)C(O)C5O)C4O)C(O)C3O)C2O)C1OOther Identifiers
Properties
HBA: | 30 | RingCount: | 10 |
HBD: | 13 | FractionCSP3: | 0.92 |
AlogP: | -2.4 | Num_rotatable_bonds: | 20 |
MolWt: | 1351.49 | Num_heavy_atoms: | 94 |
TPSA: | 443.42 | NumAromaticRings: | 0 |
Unique Aglycone
AD46764
Formula: C34H52O7
Smiles:
CC(=O)OC1CC2(C)C3CCC4C(C)(CCC(O)C4(C)C)C3=CCC23C(=O)OC(C)(C(CCC(C)C)OC(C)=O)C13HBA: | 7 | RingCount: | 5 |
HBD: | 1 | FractionCSP3: | 0.85 |
AlogP: | 6.16 | Num_rotatable_bonds: | 6 |
MolWt: | 572.78 | Num_heavy_atoms: | 41 |
TPSA: | 99.13 | NumAromaticRings: | 0 |
Sugarmoiety

SD04526
COC1C(O)C(CO)OC(OC2C(O)C(CO)OC(OC3C(C)OC(OC4C(O)OCC(OC5OC(CO)C(O)C(O)C5O)C4O)C(O)C3O)C2O)C1O