Glycoside
GD016095
Name:
NoneFormula:
C50H98O9N2Smiles:
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@H](C=NO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(C=NO)C(O)C(O)CCCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.96 |
| AlogP: | 10.47 | Num_rotatable_bonds: | 44 |
| MolWt: | 871.34 | Num_heavy_atoms: | 61 |
| TPSA: | 181.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD11624
Formula: C44H88O4N2
Smiles:
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(C=NO)C(O)C(O)CCCCCCCCCCCCCC| HBA: | 6 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.95 |
| AlogP: | 13.13 | Num_rotatable_bonds: | 41 |
| MolWt: | 709.2 | Num_heavy_atoms: | 50 |
| TPSA: | 102.15 | NumAromaticRings: | 0 |
