Glycoside
GD124966
Name:
Glycolipid G3Formula:
C60H114O15Smiles:
CCCCCCCCCCCCCCCOCC(COC1OC(CO)C(O)C(OC2OC(COC(=O)CCCCCCCCCCCCCC)C(O)C(O)C2O)C1O)OC(=O)CCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCC(=O)OC.CCCCCCCCCCCCCCCOCC(CO)OC(=O)CCCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(OC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.97 |
| AlogP: | 11.38 | Num_rotatable_bonds: | 51 |
| MolWt: | 1075.56 | Num_heavy_atoms: | 75 |
| TPSA: | 220.13 | NumAromaticRings: | 0 |
Unique Aglycone
AD50528
Formula: C16H32O2
Smiles:
CCCCCCCCCCCCCCC(=O)OC| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.94 |
| AlogP: | 5.25 | Num_rotatable_bonds: | 13 |
| MolWt: | 256.43 | Num_heavy_atoms: | 18 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
AD50529
Formula: C33H66O4
Smiles:
CCCCCCCCCCCCCCCOCC(CO)OC(=O)CCCCCCCCCCCCCC| HBA: | 4 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.97 |
| AlogP: | 10.09 | Num_rotatable_bonds: | 31 |
| MolWt: | 526.89 | Num_heavy_atoms: | 37 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
