Glycoside
GD018500
Name:
NoneFormula:
C45H87O13PSmiles:
CCCCCCCCCCCCCCCCCC(=O)OCC(COC1OC(COP(=O)(O)O)C(O)C(O)C1O)OC(=O)CCCCCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCCCCC.COP(=O)(O)OSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.96 |
| AlogP: | 9.9 | Num_rotatable_bonds: | 41 |
| MolWt: | 867.15 | Num_heavy_atoms: | 59 |
| TPSA: | 198.51 | NumAromaticRings: | 0 |
Unique Aglycone
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.02 | Num_heavy_atoms: | 6 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
AD04265
Formula: C39H76O5
Smiles:
CCCCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.95 |
| AlogP: | 11.96 | Num_rotatable_bonds: | 36 |
| MolWt: | 625.03 | Num_heavy_atoms: | 44 |
| TPSA: | 72.83 | NumAromaticRings: | 0 |
