Glycoside
GD123858
Name:
2-(hydroxymethyl)-3-[3,4,5-trihydroxy-5-(hydroxymethyl)oxolane-2-carbonyloxy]-3aH-indol-3a-ideFormula:
C15H16O8NSmiles:
O=C(Oc1c(CO)[n-]c2ccccc12)C1OC(O)(CO)C(O)C1OAglycone:
O=COc1c(CO)[n-]c2ccccc12Sugarmoiety:
OCC1(O)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -2.0 | Num_rotatable_bonds: | 4 |
| MolWt: | 338.29 | Num_heavy_atoms: | 24 |
| TPSA: | 150.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD50007
Formula: C10H8O3N
Smiles:
O=COc1c(CO)[n-]c2ccccc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 0.82 | Num_rotatable_bonds: | 3 |
| MolWt: | 190.18 | Num_heavy_atoms: | 14 |
| TPSA: | 60.63 | NumAromaticRings: | 2 |
