Glycoside
GD004989
Name:
NoneFormula:
C43H72O10Smiles:
CCCCCCCCCC=CC=CC=CC=CC=CC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
CCCCCCCCCC=CC=CC=CC=CC=CC(=O)OC(CO)COC(=O)CCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.72 |
| AlogP: | 7.88 | Num_rotatable_bonds: | 32 |
| MolWt: | 749.04 | Num_heavy_atoms: | 53 |
| TPSA: | 151.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD04280
Formula: C37H62O5
Smiles:
CCCCCCCCCC=CC=CC=CC=CC=CC(=O)OC(CO)COC(=O)CCCCCCCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.68 |
| AlogP: | 10.06 | Num_rotatable_bonds: | 29 |
| MolWt: | 586.9 | Num_heavy_atoms: | 42 |
| TPSA: | 72.83 | NumAromaticRings: | 0 |
