Glycoside
GD116155
Name:
3,4,5-trihydroxy-6-(1H-indole-3-carbonyloxy)oxane-2-carboxylic acidFormula:
C15H15O8NSmiles:
O=C(OC1OC(C(=O)O)C(O)C(O)C1O)c1c[nH]c2ccccc12Aglycone:
O=C(O)c1c[nH]c2ccccc12Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 337.28 | Num_heavy_atoms: | 24 |
| TPSA: | 149.31 | 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 |
