Glycoside
GD126704
Name:
2-{[4-carbamimidamido-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5-(carbamoyloxy)-3,4,6-trihydroxycyclohexyl carbamateFormula:
C15H27O12N5Smiles:
N=C(N)NC1C(O)C(CO)OC(OC2C(O)C(O)C(OC(=N)O)C(O)C2OC(=N)O)C1OAglycone:
N=C(O)OC1C(O)C(O)C(O)C(OC(=N)O)C1OSugarmoiety:
N=C(N)NC1C(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 2 |
| HBD: | 14 | FractionCSP3: | 0.8 |
| AlogP: | -5.49 | Num_rotatable_bonds: | 6 |
| MolWt: | 469.4 | Num_heavy_atoms: | 32 |
| TPSA: | 308.36 | NumAromaticRings: | 0 |
Unique Aglycone
AD50747
Formula: C8H14O8N2
Smiles:
N=C(O)OC1C(O)C(O)C(O)C(OC(=N)O)C1O| HBA: | 10 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.75 |
| AlogP: | -2.8 | Num_rotatable_bonds: | 2 |
| MolWt: | 266.21 | Num_heavy_atoms: | 18 |
| TPSA: | 187.54 | NumAromaticRings: | 0 |
