Glycoside
GD115341
Name:
2-amino-2-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H-indol-3-yl)acetic acidFormula:
C16H20O8N2Smiles:
NC(C(=O)O)c1c(OC2OC(CO)C(O)C(O)C2O)[nH]c2ccccc12Aglycone:
NC(C(=O)O)c1c(O)[nH]c2ccccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.44 |
| AlogP: | -1.57 | Num_rotatable_bonds: | 5 |
| MolWt: | 368.34 | Num_heavy_atoms: | 26 |
| TPSA: | 178.49 | NumAromaticRings: | 2 |
Unique Aglycone
AD45606
Formula: C10H10O3N2
Smiles:
NC(C(=O)O)c1c(O)[nH]c2ccccc12| HBA: | 5 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.1 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 2 |
| MolWt: | 206.2 | Num_heavy_atoms: | 15 |
| TPSA: | 99.34 | NumAromaticRings: | 2 |
