Glycoside
GD138940
Name:
Indole-3-Carboxylic Acid Beta-D-Glucopyranosyl EsterFormula:
C15H17O7NSmiles:
O=C(OC1OC(CO)C(O)C(O)C1O)c1c[nH]c2ccccc12Aglycone:
O=C(O)c1c[nH]c2ccccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 3 |
| MolWt: | 323.3 | Num_heavy_atoms: | 23 |
| TPSA: | 132.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD45110
Formula: C9H7O2N
Smiles:
O=C(O)c1c[nH]c2ccccc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 161.16 | Num_heavy_atoms: | 12 |
| TPSA: | 53.09 | NumAromaticRings: | 2 |
