Glycoside
GD150284
Name:
6-{4-[2-amino-1-(1-hydroxycyclohexyl)ethyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acidFormula:
C20H29O8NSmiles:
NCC(c1ccc(OC2OC(C(=O)O)C(O)C(O)C2O)cc1)C1(O)CCCCC1Aglycone:
NCC(c1ccc(O)cc1)C1(O)CCCCC1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.65 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 411.45 | Num_heavy_atoms: | 29 |
| TPSA: | 162.7 | NumAromaticRings: | 1 |
Unique Aglycone
AD60045
Formula: C14H21O2N
Smiles:
NCC(c1ccc(O)cc1)C1(O)CCCCC1| HBA: | 3 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 235.33 | Num_heavy_atoms: | 17 |
| TPSA: | 66.48 | NumAromaticRings: | 1 |
