Glycoside
GD125284
Name:
4-{3-[(diaminomethylidene)amino]propyl}-1H-indol-3-yl 3,4,5-trihydroxy-5-(hydroxymethyl)oxolane-2-carboxylateFormula:
C18H24O7N4Smiles:
N=C(N)NCCCc1cccc2[nH]cc(OC(=O)C3OC(O)(CO)C(O)C3O)c12Aglycone:
N=C(N)NCCCc1cccc2[nH]cc(OC=O)c12Sugarmoiety:
OCC1(O)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.44 |
| AlogP: | -1.71 | Num_rotatable_bonds: | 7 |
| MolWt: | 408.41 | Num_heavy_atoms: | 29 |
| TPSA: | 194.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD50667
Formula: C13H16O2N4
Smiles:
N=C(N)NCCCc1cccc2[nH]cc(OC=O)c12| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.23 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 6 |
| MolWt: | 260.3 | Num_heavy_atoms: | 19 |
| TPSA: | 103.99 | NumAromaticRings: | 2 |
