Glycoside

GD116045
Name:
NoneFormula:
C60H113O21NSmiles:
CCCCCCCCCCCCCCCCCCCCCCC(O)C(=O)C(O)C(O)=NC(COC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(OC2OC(C)C(O)C(O)C2O)C1O)C(O)C(O)CCCCCCCCCCCCAglycone:
CCCCCCCCCCCCC(O)C(O)C([NH])CO.CCCCCCCCCCCCCCCCCCCCCCSugarmoiety:
CC1OC(OC2C(O)C(O)OC(CO)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O.O=C(CO)C(O)COOther Identifiers
Properties
HBA: | 22 | RingCount: | 3 |
HBD: | 14 | FractionCSP3: | 0.97 |
AlogP: | 4.34 | Num_rotatable_bonds: | 47 |
MolWt: | 1184.55 | Num_heavy_atoms: | 82 |
TPSA: | 368.03 | NumAromaticRings: | 0 |
Unique Aglycone
AD20532
Formula: C22H46
Smiles:
CCCCCCCCCCCCCCCCCCCCCCHBA: | 0 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 1.0 |
AlogP: | 8.83 | Num_rotatable_bonds: | 19 |
MolWt: | 310.61 | Num_heavy_atoms: | 22 |
TPSA: | 0.0 | NumAromaticRings: | 0 |
AD46017
Formula: C16H34O3N
Smiles:
CCCCCCCCCCCCC(O)C(O)C([NH])COHBA: | 4 | RingCount: | 0 |
HBD: | 4 | FractionCSP3: | 1.0 |
AlogP: | 2.66 | Num_rotatable_bonds: | 14 |
MolWt: | 288.45 | Num_heavy_atoms: | 20 |
TPSA: | 84.49 | NumAromaticRings: | 0 |