Glycoside
GD118178
Name:
2-(hydroxymethyl)-1H-indol-3-yl 3,4,5-trihydroxy-5-(hydroxymethyl)oxolane-2-carboxylateFormula:
C15H17O8NSmiles:
O=C(Oc1c(CO)[nH]c2ccccc12)C1OC(O)(CO)C(O)C1OAglycone:
O=COc1c(CO)[nH]c2ccccc12Sugarmoiety:
OCC1(O)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | -1.63 | Num_rotatable_bonds: | 4 |
| MolWt: | 339.3 | Num_heavy_atoms: | 24 |
| TPSA: | 152.47 | NumAromaticRings: | 2 |
Unique Aglycone
AD47225
Formula: C10H9O3N
Smiles:
O=COc1c(CO)[nH]c2ccccc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 191.19 | Num_heavy_atoms: | 14 |
| TPSA: | 62.32 | NumAromaticRings: | 2 |
