Glycoside

GD115664
Name:
l-rhodinose-2-deoxy-l-fucose-2-deoxy-l-fucose-10-decarbomethoxy- epsilon-rhodomycinoneFormula:
C37H48O15Smiles:
CCC1(O)CC2=C(O)C3C(=O)c4cccc(O)c4C(=O)C3C(O)=C2C(OC2CC(O)C(OC3CC(O)C(OC4CCCC(O)O4)C(C)O3)C(C)O2)C1Aglycone:
CCC1(O)CC2=C(O)C3C(=O)c4cccc(O)c4C(=O)C3C(O)=C2C(O)C1.OC1CCCC(O)O1Sugarmoiety:
CC1OC(OC2C(O)CC(O)OC2C)CC(O)C1OOther Identifiers
Properties
HBA: | 15 | RingCount: | 7 |
HBD: | 7 | FractionCSP3: | 0.68 |
AlogP: | 2.57 | Num_rotatable_bonds: | 7 |
MolWt: | 732.78 | Num_heavy_atoms: | 52 |
TPSA: | 231.13 | NumAromaticRings: | 1 |
Unique Aglycone
AD45797
Formula: C20H20O7
Smiles:
CCC1(O)CC2=C(O)C3C(=O)c4cccc(O)c4C(=O)C3C(O)=C2C(O)C1HBA: | 7 | RingCount: | 4 |
HBD: | 5 | FractionCSP3: | 0.4 |
AlogP: | 1.94 | Num_rotatable_bonds: | 1 |
MolWt: | 372.37 | Num_heavy_atoms: | 27 |
TPSA: | 135.29 | NumAromaticRings: | 1 |
AD45798
Formula: C5H10O3
Smiles:
OC1CCCC(O)O1HBA: | 3 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 1.0 |
AlogP: | -0.18 | Num_rotatable_bonds: | 0 |
MolWt: | 118.13 | Num_heavy_atoms: | 8 |
TPSA: | 49.69 | NumAromaticRings: | 0 |