Glycoside
GD132844
Name:
4-(hydroxymethyl)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino}-3a,4,5,6,7,7a-hexahydro-1,3-benzoxazole-4,5,6-triolFormula:
C14H24O10N2Smiles:
OCC1OC(NC2=NC3C(CC(O)C(O)C3(O)CO)O2)C(O)C(O)C1OAglycone:
NC1=NC2C(CC(O)C(O)C2(O)CO)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.93 |
| AlogP: | -5.65 | Num_rotatable_bonds: | 3 |
| MolWt: | 380.35 | Num_heavy_atoms: | 26 |
| TPSA: | 204.69 | NumAromaticRings: | 0 |
Unique Aglycone
AD53780
Formula: C8H14O5N2
Smiles:
NC1=NC2C(CC(O)C(O)C2(O)CO)O1| HBA: | 7 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -3.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 218.21 | Num_heavy_atoms: | 15 |
| TPSA: | 128.53 | NumAromaticRings: | 0 |
