Glycoside
GD021922
Name:
NoneFormula:
C29H39O6N3Smiles:
CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CC(=O)Nc1ccn([C@@H]2O[C@H](CO)C(O)[C@H]2O)c(=O)n1Aglycone:
CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CC(=O)Nc1cc[nH]c(=O)n1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.48 |
| AlogP: | 3.32 | Num_rotatable_bonds: | 8 |
| MolWt: | 525.65 | Num_heavy_atoms: | 38 |
| TPSA: | 133.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD14918
Formula: C24H31O2N3
Smiles:
CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CC(=O)Nc1cc[nH]c(=O)n1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 5.24 | Num_rotatable_bonds: | 6 |
| MolWt: | 393.53 | Num_heavy_atoms: | 29 |
| TPSA: | 74.85 | NumAromaticRings: | 1 |
