Glycoside
GD115767
Name:
3-[3,4,5-trihydroxy-5-(hydroxymethyl)oxolane-2-carbonyloxy]-3aH-indol-3a-ideFormula:
C14H14O7NSmiles:
O=C(Oc1c[n-]c2ccccc12)C1OC(O)(CO)C(O)C1OAglycone:
O=COc1c[n-]c2ccccc12Sugarmoiety:
OCC1(O)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.36 |
| AlogP: | -1.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 308.27 | Num_heavy_atoms: | 22 |
| TPSA: | 130.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD45859
Formula: C9H6O2N
Smiles:
O=COc1c[n-]c2ccccc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 2 |
| MolWt: | 160.15 | Num_heavy_atoms: | 12 |
| TPSA: | 40.4 | NumAromaticRings: | 2 |
