Glycoside
GD028241
Name:
NoneFormula:
C46H81O10N3Smiles:
CCCCCCCCCCCCCC[C@H](O)[C@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)n1cc(COCCCCCCCCCCCCOCc2ccccc2)nn1Aglycone:
CCCCCCCCCCCCCCC(O)C(O)C(CO)n1cc(COCCCCCCCCCCCCOCc2ccccc2)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.83 |
| AlogP: | 7.08 | Num_rotatable_bonds: | 37 |
| MolWt: | 836.16 | Num_heavy_atoms: | 59 |
| TPSA: | 189.01 | NumAromaticRings: | 2 |
Unique Aglycone
AD18477
Formula: C40H71O5N3
Smiles:
CCCCCCCCCCCCCCC(O)C(O)C(CO)n1cc(COCCCCCCCCCCCCOCc2ccccc2)nn1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | 9.26 | Num_rotatable_bonds: | 34 |
| MolWt: | 674.02 | Num_heavy_atoms: | 48 |
| TPSA: | 109.86 | NumAromaticRings: | 2 |
