Glycoside

GD144084
Name:
NoneFormula:
C60H96O28Smiles:
COC1C(O)C(CO)OC(OC2C(O)C(CO)OC(OC3C(C)OC(OC4C(OC5CCC6(C)C7=CC(O)C89C(=O)OC(C)(CCC=C(C)C)C8(O)CCC9(C)C7CCC6C5(C)C)OCC(OC5OC(CO)C(O)C(O)C5O)C4O)C(O)C3O)C2O)C1OAglycone:
CC(C)=CCCC1(C)OC(=O)C23C(O)C=C4C(CCC5C4(C)CCC(O)C5(C)C)C2(C)CCC13OSugarmoiety:
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: | 28 | RingCount: | 10 |
HBD: | 15 | FractionCSP3: | 0.92 |
AlogP: | -3.48 | Num_rotatable_bonds: | 17 |
MolWt: | 1265.4 | Num_heavy_atoms: | 88 |
TPSA: | 431.28 | NumAromaticRings: | 0 |
Unique Aglycone
AD56011
Formula: C30H46O5
Smiles:
CC(C)=CCCC1(C)OC(=O)C23C(O)C=C4C(CCC5C4(C)CCC(O)C5(C)C)C2(C)CCC13OHBA: | 5 | RingCount: | 5 |
HBD: | 3 | FractionCSP3: | 0.83 |
AlogP: | 5.08 | Num_rotatable_bonds: | 3 |
MolWt: | 486.69 | Num_heavy_atoms: | 35 |
TPSA: | 86.99 | 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