Glycoside
GD120512
Name:
NoneFormula:
C56H108O15N2Smiles:
CCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(CO)C(OC2OC(CO)C(O)C(O)C2N=C(C)O)C(O)C1O)C(O)C(O)CCCCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCCCCCCSugarmoiety:
CC(O)=NC1C(OC2C(CO)OC(O)C(O)C2O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 2 |
| HBD: | 11 | FractionCSP3: | 0.96 |
| AlogP: | 8.32 | Num_rotatable_bonds: | 46 |
| MolWt: | 1049.48 | Num_heavy_atoms: | 73 |
| TPSA: | 284.17 | NumAromaticRings: | 0 |
Unique Aglycone
AD48427
Formula: C42H85O5N
Smiles:
CCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCCCCCC| HBA: | 6 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.98 |
| AlogP: | 11.69 | Num_rotatable_bonds: | 39 |
| MolWt: | 684.14 | Num_heavy_atoms: | 48 |
| TPSA: | 113.51 | NumAromaticRings: | 0 |
