Glycoside
GD114338
Name:
N-(3-carbamimidamido-4-{[3,4-dihydroxy-4-(hydroxymethyl)-5-methyloxolan-2-yl]oxy}-2,5,6-trihydroxycyclohexyl)guanidineFormula:
C14H28O8N6Smiles:
CC1OC(OC2C(O)C(O)C(NC(=N)N)C(O)C2NC(=N)N)C(O)C1(O)COAglycone:
N=C(N)NC1C(O)C(O)C(O)C(NC(=N)N)C1OSugarmoiety:
CC1OC(O)C(O)C1(O)COOther Identifiers
Properties
| HBA: | 14 | RingCount: | 2 |
| HBD: | 14 | FractionCSP3: | 0.86 |
| AlogP: | -6.0 | Num_rotatable_bonds: | 5 |
| MolWt: | 408.41 | Num_heavy_atoms: | 28 |
| TPSA: | 263.64 | NumAromaticRings: | 0 |
Unique Aglycone
AD07399
Formula: C8H18O4N6
Smiles:
N=C(N)NC1C(O)C(O)C(O)C(NC(=N)N)C1O| HBA: | 10 | RingCount: | 1 |
| HBD: | 12 | FractionCSP3: | 0.75 |
| AlogP: | -4.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 262.27 | Num_heavy_atoms: | 18 |
| TPSA: | 204.72 | NumAromaticRings: | 0 |
