Glycoside
GD022319
Name:
4-{[3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,5,6,7-tetrahydroxy-hexahydro-2H-1,3,2λâµ-benzodioxaphosphol-2-oneFormula:
C12H22O12NPSmiles:
NC1[C@H](O[C@@H]2C(O)C(O)[C@H](O)C3OP(=O)(O)O[C@H]32)OC(CO)[C@H](O)[C@H]1OAglycone:
O=P1(O)OC2C(O)C(O)C(O)C(O)C2O1Sugarmoiety:
NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 1.0 |
| AlogP: | -4.88 | Num_rotatable_bonds: | 3 |
| MolWt: | 403.28 | Num_heavy_atoms: | 26 |
| TPSA: | 221.62 | NumAromaticRings: | 0 |
Unique Aglycone
AD06706
Formula: C6H11O8P
Smiles:
O=P1(O)OC2C(O)C(O)C(O)C(O)C2O1| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | -2.67 | Num_rotatable_bonds: | 0 |
| MolWt: | 242.12 | Num_heavy_atoms: | 15 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
