Glycoside
GD142580
Name:
2-hexanamido-3-{1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1H-indol-3-yl}propanoic acidFormula:
C23H32O8N2Smiles:
CCCCCC(O)=NC(Cc1cn(C2OC(CO)C(O)C(O)C2O)c2ccccc12)C(=O)OAglycone:
CCCCCC(O)=NC(Cc1c[nH]c2ccccc12)C(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.57 |
| AlogP: | 1.15 | Num_rotatable_bonds: | 10 |
| MolWt: | 464.52 | Num_heavy_atoms: | 33 |
| TPSA: | 164.97 | NumAromaticRings: | 2 |
Unique Aglycone
AD57375
Formula: C17H22O3N2
Smiles:
CCCCCC(O)=NC(Cc1c[nH]c2ccccc12)C(=O)O| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.41 |
| AlogP: | 3.7 | Num_rotatable_bonds: | 8 |
| MolWt: | 302.37 | Num_heavy_atoms: | 22 |
| TPSA: | 85.68 | NumAromaticRings: | 2 |
